2-chloroacetonitrile

Modify Date: 2024-01-01 18:00:50

2-chloroacetonitrile Structure
2-chloroacetonitrile structure
Common Name 2-chloroacetonitrile
CAS Number 107-14-2 Molecular Weight 75.497
Density 1.1±0.1 g/cm3 Boiling Point 126.5±0.0 °C at 760 mmHg
Molecular Formula C2H2ClN Melting Point 38℃
MSDS Chinese USA Flash Point 47.8±0.0 °C
Symbol GHS02 GHS06 GHS09
GHS02, GHS06, GHS09
Signal Word Danger

 Names

Name Chloroacetonitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.1±0.1 g/cm3
Boiling Point 126.5±0.0 °C at 760 mmHg
Melting Point 38℃
Molecular Formula C2H2ClN
Molecular Weight 75.497
Flash Point 47.8±0.0 °C
Exact Mass 74.987579
PSA 23.79000
LogP 0.14
Vapour density 3 (vs air)
Vapour Pressure 11.6±0.2 mmHg at 25°C
Index of Refraction 1.400
Stability Stable, but reacts with water. Combustible. Incompatible with water, moisture, strong oxidizing agents, acids.
Water Solubility INSOLUBLE

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AL8225000
CHEMICAL NAME :
Acetonitrile, chloro-
CAS REGISTRY NUMBER :
107-14-2
BEILSTEIN REFERENCE NO. :
0506028
LAST UPDATED :
199710
DATA ITEMS CITED :
19
MOLECULAR FORMULA :
C2-H2-Cl-N
MOLECULAR WEIGHT :
75.50
WISWESSER LINE NOTATION :
NC1G

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Open irritation test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration into the eye
SPECIES OBSERVED :
Rodent - rabbit
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
220 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LCLo - Lowest published lethal concentration
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
250 ppm/4H
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
139 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
71 uL/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
4800 mg/kg/2W-I
TOXIC EFFECTS :
Tumorigenic - Carcinogenic by RTECS criteria Skin and Appendages - tumors
TYPE OF TEST :
Micronucleus test
TYPE OF TEST :
Unscheduled DNA synthesis

MUTATION DATA

TYPE OF TEST :
Sister chromatid exchange
TEST SYSTEM :
Rodent - hamster Ovary
DOSE/DURATION :
79100 nmol/L
REFERENCE :
FAATDF Fundamental and Applied Toxicology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1981- Volume(issue)/page/year: 5,1065,1985 *** REVIEWS *** IARC Cancer Review:Animal Inadequate Evidence IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 52,269,1991 IARC Cancer Review:Human No Available Data IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 52,269,1991 IARC Cancer Review:Group 3 IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 52,269,1991

 Safety Information

Symbol GHS02 GHS06 GHS09
GHS02, GHS06, GHS09
Signal Word Danger
Hazard Statements H226-H301 + H311 + H331-H411
Precautionary Statements Missing Phrase - N15.00950417-P210-P280-P302 + P352 + P312-P304 + P340 + P312-P370 + P378
Personal Protective Equipment Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Hazard Codes T:Toxic
Risk Phrases R23/24/25;R51/53
Safety Phrases S45-S61
RIDADR UN 2668 6.1/PG 2
WGK Germany 3
RTECS AL8225000
Packaging Group II
Hazard Class 6.1
HS Code 2926909090

 Synthetic Route

 Customs

HS Code 2926909090
Summary HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

 Articles19

More Articles
Genotoxic activity of five haloacetonitriles: comparative investigations in the single cell gel electrophoresis (comet) assay and the ames-fluctuation test.

Environ. Mol. Mutagen. 36(1) , 52-8, (2000)

Halogenated acetonitriles (HANs) are known to be water disinfectant by-products. Their mutagenicity and carcinogenicity have been shown in different test systems in vivo and in vitro. They also have c...

Percutaneous absorption of haloacetonitriles and chloral hydrate and simulated human exposures.

J. Appl. Toxicol. 32(6) , 387-94, (2012)

Disinfection-by-products (DBPs) have long been a human health concern and many are known carcinogens and teratogens. Skin is exposed to DBPs in water through bathing and swimming; however, dermal upta...

Chloroacetonitrile induces intrauterine growth restriction and musculoskeletal toxicity in fetal mouse.

Toxicol. Ind. Health 24(8) , 511-8, (2008)

Chloroacetonitrile (CAN) is a by-product of chlorination of drinking water. Epidemiological studies indicate that it might present a hazard to human health. The present study was designed to investiga...

 Synonyms

2-chloroacetonitrile
EINECS 203-467-0
MFCD00001885
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