CAS 94-96-2 MFCD00004578-2-Ethyl-1,3-Hexanediol 2-乙基-1,3-己二醇 TAO{mole}

2-Ethyl-1,3-Hexanediol 2-乙基-1,3-己二醇

CAS 94-96-2 MFCD00004578

化学结构图

SMILES: CCCC(O)C(CC)CO

化学属性

Mol. Formula	C8H18O2
Mol. Weight	146.23
Refractive index	1.4500 to 1.4520
Boiling Point	244°C(lit.)
Density	0.9422
Melting Point	-40
TSCA	Yes
Vapor Density	5 (vs air)
Flash Point	130°C(lit.)
Solubility	42 G/L (20 ºC)
Stability	易吸潮

别名和识别编码

Chemical Name	2-Ethyl-1,3-Hexanediol
Synonym	Ethylhexylene glycol ETHYL HEXANEDIOL {Chemicalbook} {Chem { 驱蚊醇 2-Ethylhexanediol 1,3-Hexanediol, 2-ethyl- 2-ethyl-1,3-hexanediol Ethyl hexanediol 2 2-Ethylhexane-1,3-diol, Ethohexadiol
CAS Number	94-96-2
PubChem Substance ID	7211
EC Number	202-377-9
Beilstein Registry Number	1(4)2597
MDL Number	MFCD00004578
Reaxys-RN	1735324
Merck Number	3744
Chemical Name Translation	2-乙基-1,3-己二醇
Wiswesser Line Notation	QY3&Y2&1Q
InChI	InChI=1S/C8H18O2/c1-3-5-8(10)7(4-2)6-9/h7-10H,3-6H2,1-2H3

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品牌质保精细包装现货库存一流品牌服务

产品应用

用于有机合成，可制取聚酯树脂、聚酯增塑剂、聚氨酯树脂等。该品对蚊蝇是有效的驱虫剂，也可用于生产化妆品或作为油墨溶剂。

安全信息

GHS Symbol

WGK Germany1

Hazard statements

H302+H312
H318 Causes serious eye damage 严重伤害眼睛
H303 May be harmfully swallowed 吞食可能有害

Personal Protective Equipment Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter

Hazard Codes Xi

RTECSMO2625000

Precautionary statements

P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
P302+P352+P312
P305+P351+P338+P310
P301+P312+P330
P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
P501 Dispose of contents/container to..… 处理内容物/容器.....
P312 Call a POISON CENTER or doctor/physician if you feel unwell. 如果你感觉不适，呼叫解毒中心或医生/医师。
P332+P313
P302+P352+P312+P362+P364
P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西，喝水或吸烟。
P305+P351+P338
P302+P350

Signal word

Safety Statements

Risk Statements

Storage condition 密封保存易吸潮，密封保存

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Bird - chicken
DOSE/DURATION           : 1400 uL/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JPETAB Journal of Pharmacology and Experimental Therapeutics.  (Williams &
   Wilkins Co., 428 E. Preston St., Baltimore, MD 21202)  V.1-    1909/10-
   Volume(issue)/page/year: 93,26,1948

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - rabbit

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rabbit
DOSE/DURATION           : 2600 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   PCOC** Pesticide Chemicals Official Compendium, Association of the American
   Pesticide Control Officials, Inc., 1966.  (Topeka, KS)
   Volume(issue)/page/year: -,508,1966

TYPE OF TEST            : LC - Lethal concentration
ROUTE OF EXPOSURE       : Inhalation
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : >4800 ppm/8H
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   UCDS** Union Carbide Data Sheet.  (Union Carbide Corp., 39 Old Ridgebury
   Rd., Danbury, CT 06817)  Volume(issue)/page/year: 11/3/1971

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 1400 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   SPEADM Special Publication of the Entomological Society of America.  (4603
   Calvert Rd., College Park, MD 20740)  Volume(issue)/page/year: 78-1,52,1978

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 20 gm/kg
SEX/DURATION            : female 6-15 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Specific Developmental Abnormalities - other developmental
   abnormalities
REFERENCE :
   EPASR* United States Environmental Protection Agency, Office of Pesticides
   and Toxic Substances. (U.S. Environmental Protection Agency, 401 M St., SW,
   Washington, DC 20460)  History unknown.  Volume(issue)/page/year:
   8EHQ-1288-0778

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 20 gm/kg
SEX/DURATION            : female 6-15 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Fertility - post-implantation mortality (e.g. dead and/or
   resorbed implants per total number of implants)
   Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death,
   e.g., stunted fetus)
   Reproductive - Specific Developmental Abnormalities - musculoskeletal system
REFERENCE :
   EPASR* United States Environmental Protection Agency, Office of Pesticides
   and Toxic Substances. (U.S. Environmental Protection Agency, 401 M St., SW,
   Washington, DC 20460)  History unknown.  Volume(issue)/page/year:
   8EHQ-1288-0778

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 40 mL/kg
SEX/DURATION            : female 6-15 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Maternal Effects - other effects
   Reproductive - Specific Developmental Abnormalities - musculoskeletal system
   Reproductive - Specific Developmental Abnormalities - urogenital system
REFERENCE :
   JTOTDO Journal of Toxicology, Cut

其他信息

上游原料:丁醛
毒性分级:中毒
溶于醇和醚。在水中溶解度为0.6%（重）。水中该品中的溶解度10.8%，无气味，有吸湿性。
MOL 文件:94-96-2.mol
海关编码:29053980
图谱信息:2-乙基-1,3-己二醇(94-96-2)Raman光谱 2-乙基-1,3-己二醇(94-96-2)红外图谱(IR1) 2-乙基-1,3-己二醇(94-96-2)红外图谱(IR2) 2-乙基-1,3-己二醇(94-96-2)核磁图( 1 HNMR) 2-乙基-1,3-己二醇(94-96-2)质谱(MS) 2-乙基-1,3-己二醇(94-96-2)核磁图( 13 CNMR)
蒸气密度:5 (vs air)
可燃性危险特性:遇明火、高温、强氧化剂可燃; 燃烧排放刺激烟雾
刺激数据:皮肤- 兔子 500 毫克轻度; 眼- 兔子 20 毫克重度
Alfa Aesar:2-乙基己烷-1,3-二醇,97% 2-Ethylhexane-1,3-diol, 97%(94-96-2)
类别:易燃液体
储运特性:包装完整、轻装轻放; 库房通风、远离明火、高温、与氧化剂分开存放
Sigma Aldrich:94-96-2(sigmaaldrich)
敏感性:Hygroscopic
急性毒性:口服- 大鼠 LD50: 1400 毫克/ 公斤; 口服- 小鼠 LD50: 1900 毫克/ 公斤
外观性质:无色、无臭液体, 有吸湿性。
方法一:先由丙烯合成丁醛，在碱或酸的催化下，丁醛自身缩合生成2-乙基-3-羟基已醛。这一化合物很不稳定，经加氢即得2-乙基-1,3-已二醇。
用途一:用于有机合成，可制取聚酯树脂、聚酯增塑剂、聚氨酯树脂等。该品对蚊蝇是有效的驱虫剂，也可用于生产化妆品或作为油墨溶剂。
MSDS 信息:2-乙基-1,3-己二醇(94-96-2).msds
Acros Organics:2-乙基-1,3-已二醇 2-Ethyl-1,3-hexanediol, mixture of isomers, 99%(94-96-2)
TCI Shanghai:2-乙基-1,3-己二醇(非对映异构体类的混合物) 2-Ethyl-1,3-hexanediol (mixture of diastereoisomers),>;98.0%(GC)(94-96-2)
2-乙基-1,3-己二醇价格(试剂级):更新日期产品编号产品名称包装价格 2011/08/23 AE2912502 2-乙基-1，3-己二醇;2-乙基-3-丙基-1,3-丙二醇 500g 683元 2011/08/23 LA1089801 2-乙基-1,3-己二醇;2-乙基-3-丙基-1,3-丙二醇 500ml 370元 2011/08/23 K0402002 2-乙基-1.3-己二醇 1L 892元
灭火剂:泡沫、二氧化碳、干粉、砂土