5510-99-6

5510-99-6结构式
5510-99-6结构式

化源商城直购

中文名 2,6-二仲丁基苯酚
英文名 2,6-di(butan-2-yl)phenol
中文别名 双邻仲丁基酚
英文别名 2,6-Di-sec-butylphenol
UNII:862GFQ832E
MFCD00009330
2,6-di(butan-2-yl)phenol
2,6-DI-SEC-BUTYL PHENOL
Di-sec-butylphenol,mixed isomers
Phenol, 2,6-bis(1-methylpropyl)-
EINECS 226-854-6
PHENOL,2,6-DI-sec-BUTYL
密度 0.9±0.1 g/cm3
沸点 257.5±0.0 °C at 760 mmHg
熔点 -42ºC
分子式 C14H22O
分子量 206.324
闪点 127.4±7.2 °C
精确质量 206.167068
PSA 20.23000
LogP 5.22
外观性状 琥珀色液体
蒸汽压 0.0±0.5 mmHg at 25°C
折射率 1.507
稳定性

常温常压下稳定。与强氧化剂反应。

计算化学

1.疏水参数计算参考值(XlogP):无

2.氢键供体数量:1

3.氢键受体数量:1

4.可旋转化学键数量:4

5.互变异构体数量:2

6.拓扑分子极性表面积20.2

7.重原子数量:15

8.表面电荷:0

9.复杂度:160

10.同位素原子数量:0

11.确定原子立构中心数量:0

12.不确定原子立构中心数量:2

13.确定化学键立构中心数量:0

14.不确定化学键立构中心数量:0

15.共价键单元数量:1

更多

1. 性状:黄色透明液体

2. 密度(g/mL,25℃):0.918

3. 相对蒸汽密度(g/mL,空气=1):未确定

4. 熔点(ºC):-42

5. 沸点(ºC,常压):255-260

6. 沸点(ºC,0.5mmHg):未确定

7. 折射率(n20/D):1.508

8. 闪点(ºC):127

9. 比旋光度(º):未确定

10. 自燃点或引燃温度(ºC):未确定

11. 蒸气压(mmHg,20ºC):<0.01

12. 饱和蒸气压(kPa,25ºC):未确定

13. 燃烧热(KJ/mol):未确定

14. 临界温度(ºC):未确定

15. 临界压力(KPa):未确定

16. 油水(辛醇/水)分配系数的对数值:未确定

17. 爆炸上限(%,V/V):未确定

18. 爆炸下限(%,V/V):未确定

19. 溶解性:未确定

Name: Di-sec-butylphenol tech. 92+% mixture of isomers predom. Material Safety Data Sheet
Synonym: 2,6-Di-sec-butylfenol; Phenol, 2,6-bis (1-methylpropyl)
CAS: 5510-99-6
Section 1 - Chemical Product MSDS Name:Di-sec-butylphenol tech. 92+% mixture of isomers predom. Material Safety Data Sheet
Synonym:2,6-Di-sec-butylfenol; Phenol, 2,6-bis (1-methylpropyl)

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
5510-99-6 Di-sec-butylphenol, tech. (predom. 2,6 92+ 226-854-6
Hazard Symbols: C
Risk Phrases: 34

Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
Causes burns.Corrosive.
Potential Health Effects
Eye:
Causes eye burns.
Skin:
Causes skin burns.
Ingestion:
May cause severe and permanent damage to the digestive tract. Causes gastrointestinal tract burns.
Inhalation:
Causes chemical burns to the respiratory tract.
Chronic:
No information found.

Section 4 - FIRST AID MEASURES
Eyes: Immediately flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid immediately. Do NOT allow victim to rub eyes or keep eyes closed.
Extensive irrigation with water is required (at least 30 minutes).
Skin:
Get medical aid immediately. Immediately flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes. Wash clothing before reuse. Destroy contaminated shoes.
Ingestion:
Do not induce vomiting. If victim is conscious and alert, give 2-4 cupfuls of milk or water. Never give anything by mouth to an unconscious person. Get medical aid immediately.
Inhalation:
Get medical aid immediately. Remove from exposure and move to fresh air immediately. If breathing is difficult, give oxygen. Do NOT use mouth-to-mouth resuscitation. If breathing has ceased apply artificial respiration using oxygen and a suitable mechanical device such as a bag and a mask.
Notes to Physician:

Section 5 - FIRE FIGHTING MEASURES
General Information:
As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion. Water may be ineffective. Material is lighter than water and a fire may be spread by the use of water. Vapors may be heavier than air. They can spread along the ground and collect in low or confined areas.
Extinguishing Media:
In case of fire, use water, dry chemical, chemical foam, or alcohol-resistant foam.

Section 6 - ACCIDENTAL RELEASE MEASURES
General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Absorb spill with inert material (e.g. vermiculite, sand or earth), then place in suitable container. Clean up spills immediately, observing precautions in the Protective Equipment section. Provide ventilation.

Section 7 - HANDLING and STORAGE
Handling:
Keep container tightly closed. Do not get on skin or in eyes. Do not ingest or inhale. Use with adequate ventilation. Discard contaminated shoes.
Storage:
Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. Corrosives area.

Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
Engineering Controls:
Facilities storing or utilizing this material should be equipped with an eyewash facility and a safety shower. Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 5510-99-6: Personal Protective Equipment Eyes: Wear appropriate protective eyeglasses or chemical safety goggles as described by OSHA's eye and face protection regulations in 29 CFR 1910.133 or European Standard EN166.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to prevent skin exposure.
Respirators:
A respiratory protection program that meets OSHA's 29 CFR 1910.134 and ANSI Z88.2 requirements or European Standard EN 149 must be followed whenever workplace conditions warrant respirator use.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES

Physical State: Liquid
Color: Amber Liquid
Odor: None reported.
pH: Not available.
Vapor Pressure: < 0.1 mm Hg @ 20 C
Viscosity: Not available.
Boiling Point: 255.0 - 260.0 deg C @ 760.00m
Freezing/Melting Point: -42 deg C
Autoignition Temperature: Not available.
Flash Point: 127 deg C ( 260.60 deg F)
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density: .9180g/cm3
Molecular Formula: C14H22O
Molecular Weight: 206.33

Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Stable under normal temperatures and pressures.
Conditions to Avoid:
Incompatible materials, strong oxidants.
Incompatibilities with Other Materials:
Strong oxidizing agents.
Hazardous Decomposition Products:
Carbon monoxide, carbon dioxide.
Hazardous Polymerization: Has not been reported.

Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 5510-99-6: SK8225000 LD50/LC50:
CAS# 5510-99-6: Draize test, rabbit, eye: 50 ug/24H Severe; Draize test, rabbit, skin: 2 mg/24H Severe.
Intravenous, rabbit: LDLo = 10 Carcinogenicity:
Di-sec-butylphenol, tech. (predom. 2,6-isomer) - Not listed by ACGIH, IARC, or NTP.
Other:
See actual entry in RTECS for complete information.

Section 12 - ECOLOGICAL INFORMATION


Section 13 - DISPOSAL CONSIDERATIONS
Dispose of in a manner consistent with federal, state, and local regulations.

Section 14 - TRANSPORT INFORMATION

IATA
Shipping Name: ALKYLPHENOLS, LIQUID, N.O.S.
Hazard Class: 8
UN Number: 3145
Packing Group: III
IMO
Shipping Name: ALKYLPHENOLS, LIQUID, N.O.S.
Hazard Class: 8
UN Number: 3145
Packing Group: III
RID/ADR
Shipping Name: ALKYLPHENOLS, LIQUID, N.O.S.
Hazard Class: 8
UN Number: 3145
Packing group: III

Section 15 - REGULATORY INFORMATION

European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: C
Risk Phrases:
R 34 Causes burns.
Safety Phrases:
S 24/25 Avoid contact with skin and eyes.
WGK (Water Danger/Protection)
CAS# 5510-99-6: No information available.
Canada
CAS# 5510-99-6 is listed on Canada's NDSL List.
CAS# 5510-99-6 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 5510-99-6 is listed on the TSCA inventory.


SECTION 16 - ADDITIONAL INFORMATION
N/A

毒理学数据:

1、皮肤/眼睛刺激性

标准的Draize试验:兔子,皮肤接触:2mg/24H;反应的严重程度:严重。

标准的Draize试验:兔子,眼睛接触:50μg/24H;反应的严重程度:严重。

2 、急性毒性:小鼠经口LD50:60mg/kg;兔子经静脉LDLo:10mg/kg;

CHEMICAL IDENTIFICATION

RTECS NUMBER :
SK8225000
CHEMICAL NAME :
Phenol, 2,6-di-sec-butyl-
CAS REGISTRY NUMBER :
5510-99-6
BEILSTEIN REFERENCE NO. :
2258305
LAST UPDATED :
199712
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C14-H22-O
MOLECULAR WEIGHT :
206.36
WISWESSER LINE NOTATION :
2Y1&R BQ CY2&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,228,1986
TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration into the eye
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,228,1986 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
60 mg/kg
TOXIC EFFECTS :
Behavioral - sleep Behavioral - altered sleep time (including change in righting reflex) Behavioral - analgesia
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 23,1350,1980
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
10 mg/kg
TOXIC EFFECTS :
Behavioral - general anesthetic Behavioral - sleep
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 23,1350,1980

危害码 (欧洲) Xi: Irritant;
风险声明 (欧洲) R36/37/38
安全声明 (欧洲) S26;S27;S28;S45;S24/25;S36/S37/S39
危险品运输编码 UN 3265 8/PG 2
WGK德国 3
RTECS号 SK8225000
包装等级 III
海关编码 2907199090
海关编码 2907199090
中文概述 2907199090 其他一元酚. 增值税率:17.0% 退税率:9.0% 监管条件:无 最惠国关税:5.5% 普通关税:30.0%
申报要素 品名, 成分含量, 用途
Summary 2907199090 other monophenols VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%