Cyclohexane,2-propyn-1-yl-

Modify Date: 2024-01-10 08:29:09

Cyclohexane,2-propyn-1-yl- Structure
Cyclohexane,2-propyn-1-yl- structure
Common Name Cyclohexane,2-propyn-1-yl-
CAS Number 17715-00-3 Molecular Weight 122.20700
Density 0.845 g/mL at 25 °C(lit.) Boiling Point 157-158 °C(lit.)
Molecular Formula C9H14 Melting Point N/A
MSDS N/A Flash Point 95 °F

 Names

Name prop-2-ynylcyclohexane
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.845 g/mL at 25 °C(lit.)
Boiling Point 157-158 °C(lit.)
Molecular Formula C9H14
Molecular Weight 122.20700
Flash Point 95 °F
Exact Mass 122.11000
LogP 2.59000
Vapour Pressure 1.92mmHg at 25°C
Index of Refraction n20/D 1.4590(lit.)

 MSDS


Section1. IDENTIFICATION OF THE SUBSTANCE/MIXTURE
Product name: 3-Cyclohexyl-1-propyne

Section2. HAZARDS IDENTIFICATION
Classification of the substance or mixture
According to Regulation (EC) No1272/2008
Flammable liquids (Category 3)
Acute toxicity, Oral (Category 4)
Serious eye damage (Category 1)
According to European Directive 67/548/EEC as amended.
Harmful if swallowed. Risk of serious damage to eyes. Flammable.
Label elements
Pictogram
Signal wordDanger
Hazard statement(s)
H226Flammable liquid and vapour.
H302Harmful if swallowed.
H318Causes serious eye damage.
Precautionary statement(s)
P280Wear protective gloves/ eye protection/ face protection.
P305 + P351 + P338IF IN EYES: Rinse cautiously with water for several minutes. Remove
contact lenses, if present and easy to do. Continue rinsing.
Hazard symbol(s)
XnHarmful
R-phrase(s)
R22Harmful if swallowed.
R41Risk of serious damage to eyes.
R10Flammable.
S-phrase(s)
S26In case of contact with eyes, rinse immediately with plenty of water and
seek medical advice.
S36Wear suitable protective clothing.
S16Keep away from sources of ignition - No smoking.
Other hazards - none

Section3. COMPOSITION/INFORMATION ON INGREDIENTS
Formula: C9H14
Molecular Weight: 122,21 g/mol
CAS-No.EC-No.Index-No.ClassificationConcentration
3-Cyclohexyl-1-propyne
17715-00-3--Flam. Liq. 3; Acute Tox. 4;-
Eye Dam. 1; H226, H302,
H318
Xn, R22 - R41 - R10
For the full text of the H-Statements mentioned in this Section, see Section 16.

Section4. FIRST AID MEASURES
General advice
Consult a physician. Show this safety data sheet to the doctor in attendance.
If inhaled
If breathed in, move person into fresh air. If not breathing, give artificial respiration. Consult a physician.
In case of skin contact
Wash off with soap and plenty of water. Consult a physician.
In case of eye contact
Rinse thoroughly with plenty of water for at least 15 minutes and consult a physician.
If swallowed
Do NOT induce vomiting. Never give anything by mouth to an unconscious person. Rinse mouth with water.
Consult a physician.

Section5. FIRE-FIGHTING MEASURES
Suitable extinguishing media
For small (incipient) fires, use media such as "alcohol" foam, dry chemical, or carbon dioxide. For large fires,
apply water from as far as possible. Use very large quantities (flooding) of water applied as a mist or spray;
solid streams of water may be ineffective. Cool all affected containers with flooding quantities of water.
Special protective equipment for fire-fighters
Wear self contained breathing apparatus for fire fighting if necessary.
Further information
Use water spray to cool unopened containers.

Section6. ACCIDENTAL RELEASE MEASURES
Personal precautions
Use personal protective equipment. Avoid breathing vapors, mist or gas. Ensure adequate ventilation.
Remove all sources of ignition. Evacuate personnel to safe areas. Beware of vapours accumulating to form
explosive concentrations. Vapours can accumulate in low areas.
Environmental precautions
Prevent further leakage or spillage if safe to do so. Do not let product enter drains.
Methods and materials for containment and cleaning up
Contain spillage, and then collect with an electrically protected vacuum cleaner or by wet-brushing and place
in container for disposal according to local regulations (see section 13).

Section7. HANDLING AND STORAGE
Precautions for safe handling
Avoid contact with skin and eyes. Avoid inhalation of vapour or mist.
Keep away from sources of ignition - No smoking. Take measures to prevent the build up of electrostatic
charge.
Conditions for safe storage
Keep container tightly closed in a dry and well-ventilated place. Containers which are opened must be carefully
resealed and kept upright to prevent leakage. Store in cool place.

Section8. EXPOSURE CONTROLS/PERSONAL PROTECTION
Personal protective equipment
Respiratory protection
Where risk assessment shows air-purifying respirators are appropriate use a full-face respirator with
multi-purpose combination (US) or type ABEK (EN 14387) respirator cartridges as a backup to
engineering controls. If the respirator is the sole means of protection, use a full-face supplied air
respirator. Use respirators and components tested and approved under appropriate government
standards such as NIOSH (US) or CEN (EU).
Hand protection
Handle with gloves. Gloves must be inspected prior to use. Use proper glove removal technique (without
touching glove's outer surface) to avoid skin contact with this product. Dispose of contaminated gloves
after use in accordance with applicable laws and good laboratory practices. Wash and dry hands.
The selected protective gloves have to satisfy the specifications of EU Directive 89/686/EEC and the
standard EN 374 derived from it.
Eye protection
Tightly fitting safety goggles. Faceshield (8-inch minimum). Use equipment for eye protection tested and
approved under appropriate government standards such as NIOSH (US) or EN 166(EU).
Skin and body protection
Complete suit protecting against chemicals, Flame retardant antistatic protective clothing, The type of
protective equipment must be selected according to the concentration and amount of the dangerous
substance at the specific workplace.
Hygiene measures
Handle in accordance with good industrial hygiene and safety practice. Wash hands before breaks and at
the end of workday.

Section9. PHYSICAL AND CHEMICAL PROPERTIES
Appearance
Formliquid
Colourcolourless
Safety data
pHno data available
Melting pointno data available
Boiling point157 - 158 °C - lit.
Flash point35 °C - closed cup
Ignition temperatureno data available
Lower explosion limitno data available
Upper explosion limitno data available
Density0,845 g/cm3 at 25 °C
Water solubilityno data available
Partition coefficient:log Pow: 3,06
n-octanol/water

Section10. STABILITY AND REACTIVITY
Chemical stability
Stable under recommended storage conditions.
Conditions to avoid
Heat, flames and sparks.
Materials to avoid
Strong oxidizing agents
Hazardous decomposition products
Hazardous decomposition products formed under fire conditions. - Carbon oxides

Section11. TOXICOLOGICAL INFORMATION
Acute toxicity
no data available
Skin corrosion/irritation
no data available
Serious eye damage/eye irritation
no data available
Respiratory or skin sensitization
no data available
Germ cell mutagenicity
no data available
Carcinogenicity
IARC: No component of this product present at levels greater than or equal to 0.1% is identified as
probable, possible or confirmed human carcinogen by IARC.
Reproductive toxicity
no data available
Specific target organ toxicity - single exposure
no data available
Specific target organ toxicity - repeated exposure
no data available
Aspiration hazard
no data available
Potential health effects
InhalationMay be harmful if inhaled. May cause respiratory tract irritation.
IngestionHarmful if swallowed.
SkinMay be harmful if absorbed through skin. May cause skin irritation.
EyesCauses eye burns.
Signs and Symptoms of Exposure
To the best of our knowledge, the chemical, physical, and toxicological properties have not been thoroughly
investigated.
Additional Information
RTECS: UK4725000

Section12. ECOLOGICAL INFORMATION
Toxicity
no data available
Persistence and degradability
no data available
Bioaccumulative potential
no data available
Mobility in soil
no data available
PBT and vPvB assessment
no data available
Other adverse effects
no data available

Section13. DISPOSAL CONSIDERATIONS
Product
Burn in a chemical incinerator equipped with an afterburner and scrubber but exert extra care in igniting as
this material is highly flammable. Offer surplus and non-recyclable solutions to a licensed disposal company.
Contact a licensed professional waste disposal service to dispose of this material.
Contaminated packaging
Dispose of as unused product.

Section14. TRANSPORT INFORMATION
ADR/RID
UN-Number: 1993 Class: 3Packing group: III
Proper shipping name: FLAMMABLE LIQUID, N.O.S. (3-Cyclohexyl-1-propyne)
IMDG
UN-Number: 1993 Class: 3Packing group: IIIEMS-No: F-E, S-E
Proper shipping name: FLAMMABLE LIQUID, N.O.S. (3-Cyclohexyl-1-propyne)
Marine pollutant: No
IATA
UN-Number: 1993 Class: 3Packing group: III
Proper shipping name: Flammable liquid, n.o.s. (3-Cyclohexyl-1-propyne)



SECTION 15 - REGULATORY INFORMATION
N/A


SECTION 16 - ADDITIONAL INFORMATION
N/A

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UK4725000
CHEMICAL NAME :
Propyne, 3-cyclohexyl-
CAS REGISTRY NUMBER :
17715-00-3
BEILSTEIN REFERENCE NO. :
1849402
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C9-H14
MOLECULAR WEIGHT :
122.23
WISWESSER LINE NOTATION :
L6TJ A2U1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CBCCT* "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. (National Academy of Science Library, 2101 Constitution Ave., NW, Washington, DC 20418) Volume(issue)/page/year: 4,232,1952

 Safety Information

Hazard Codes Xn: Harmful;
Risk Phrases R10
Safety Phrases S16-S26-S36
RIDADR UN 1993 3/PG 3
WGK Germany 3
RTECS UK4725000
Packaging Group III
Hazard Class 3
HS Code 2902199090

 Synthetic Route

~%

Cyclohexane,2-propyn-1-yl- Structure

Cyclohexane,2-p...

CAS#:17715-00-3

Literature: Synthetic Communications, , vol. 27, # 23 p. 4035 - 4040

~%

Cyclohexane,2-propyn-1-yl- Structure

Cyclohexane,2-p...

CAS#:17715-00-3

Literature: Recueil des Travaux Chimiques des Pays-Bas, , vol. 93, p. 183

~%

Cyclohexane,2-propyn-1-yl- Structure

Cyclohexane,2-p...

CAS#:17715-00-3

Literature: Journal of the Chemical Society - Perkin Transactions 1, , # 17 p. 2749 - 2763

~%

Cyclohexane,2-propyn-1-yl- Structure

Cyclohexane,2-p...

CAS#:17715-00-3

Literature: Journal of Organic Chemistry USSR (English Translation), , vol. 4, p. 40 - 42 Zhurnal Organicheskoi Khimii, , vol. 4, p. 44 - 47

~%

Cyclohexane,2-propyn-1-yl- Structure

Cyclohexane,2-p...

CAS#:17715-00-3

Literature: Journal of the Chemical Society, , p. 4719 - 4722

~10%

Cyclohexane,2-propyn-1-yl- Structure

Cyclohexane,2-p...

CAS#:17715-00-3

Literature: Synlett, , vol. 23, # 5 p. 747 - 750

~91%

Cyclohexane,2-propyn-1-yl- Structure

Cyclohexane,2-p...

CAS#:17715-00-3

Literature: Taherirastgar; Brandsma Synthetic Communications, 1997 , vol. 27, # 23 p. 4035 - 4040

 Customs

HS Code 2902199090
Summary 2902199090 other cyclanes, cyclenes and cyclotherpenes。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:2.0%。General tariff:30.0%

 Synonyms

3-Cyclohexylpropyne
prop-2-yn-1-ylcyclohexane
MFCD00041562
Propyne,3-cyclohexyl
3-Cyclohexyl-1-propyne
2-Propynylcyclohexane
1-Prop-2-ynylcyclohexane
cyclohexylmethylacetylene
3-cyclohexyl-prop-1-yne
Cyclohexane,2-propynyl