CAS 108-93-0 MFCD00003855-Cyclohexanol 环己醇 TAO{mole}

Cyclohexanol 环己醇

CAS 108-93-0 MFCD00003855

化学结构图

SMILES: [O]c1ccccc1

化学属性

Mol. Formula	C6H12O
Mol. Weight	100.16
Density	0.948
Refractive index	n20/D 1.465(lit.)
Flash Point	68°C
TSCA	Yes
Boiling Point	160-161°C at 760 mmHg
Melting Point	20-22°C
Autoignition Point	572 °F
Vapor Density	3.5 (vs air)
Vapor Pressure	0.98 mmHg ( 25 °C)
Solubility	微溶于水，可混溶于乙醇、乙醚、苯、乙酸乙酯、二硫化碳、油类等。
Stability	对湿度敏感

别名和识别编码

Chemical Name	Cyclohexanol
CAS Number	108-93-0
EC Number	203-630-6
Beilstein Registry Number	906744
MDL Number	MFCD00003855
Synonym	1-Cyclohexanol {LY} 1-Cyclohexanol {} {LY} 1-Cyclohexanol {} {} {LY} 1-Cyclohexanol {} {} {} {LY} 1-Cyclohexanol {} {} {} {} {LY} 1-Cyclohexanol {} {} {} {} {} {LY} 1-Cyclohexanol {} {} {} {} {} {} {LY} 1-Cyclohexanol {} {} {} {} {} {} {} {LY} 1-Cyclohexanol {} {} {} {} {} {} {} {} {LY} 1-Cyclohexanol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-Cyclohexanol {} {} {} {} {} {} {} {} {} {} {LY} 1-Cyclohexanol {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {LY} 1-Cyclohexanol {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-Cyclohexanol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-Cyclohexanol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-Cyclohexanol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-Cyclohexanol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-Cyclohexanol {} {} {} {} {}
Merck Number	14,2725
PubChem Substance ID	24846712
Chemical Name Translation	环己醇
Wiswesser Line Notation	L6TJ AQ
LabNetwork Molecule ID	LN00193182
Canonical SMILES	OC1CCCCC1

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产品应用

比色法测定钼和铼，以苯肼测定铝。以8-羰基喹啉或以碘化物测定铋时作溶剂，以提取带色物质。橡胶、树脂和硝化棉溶剂。杀虫剂。

安全信息

Signal word

GHS Symbol

WGK Germany1

Safety Statements

Risk Statements

R37/38 Irritating to respiratory system and skin 对呼吸系统和皮肤有刺激性
R20/22 Harmful by inhalation and if swallowed 吸入和不慎吞咽有害
R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性

Precautionary statements

RTECSGV7875000

Storage condition 2-8°C {LY} 2-8°C {} {LY} 2-8°C {} {} {LY} 2-8°C {} {} {} {LY} 2-8°C {} {} {} {} {LY} 2-8°C {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {}

Hazard Codes Xn

Hazard statements

H332 Harmful if inhaled 吸入有害
H315 Causes skin irritation 会刺激皮肤
H302 Harmful if swallowed 吞食有害
H335 May cause respiratory irritation 可能导致呼吸道刺激
H302+H332

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

UN Number 1993

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - rabbit
DOSE/DURATION           : 794 mg/kg
TOXIC EFFECTS :
   Behavioral - somnolence (general depressed activity)
   Liver - change in gall bladder structure or function
   Nutritional and Gross Metabolic - weight loss or decreased weight gain
REFERENCE :
   NTIS** National Technical Inf

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intramuscular
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JSICAZ Journal of Scientific and Industrial Research, Section C: Biological
   Sciences.  (New Delhi, India)  V.14-21, 1955-62.  For publisher information,
   see IJEBA6.  Volume(issue)/page/year: 21,342,1962

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 272 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans
   Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium)  V.4-   
   1898-  Volume(issue)/page/year: 135,330,1962

TYPE OF TEST            : TCLo - Lowest published toxic concentration
ROUT

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rabbit
DOSE/DURATION           : 2200 mg/kg
TOXIC EFFECTS :
   Behavioral - general anesthetic
REFERENCE :
   JIHTAB Journal of Industrial Hygiene and Toxicology.  (Cambridge, MA)
   V.18-31, 1936-49.  For publisher information, see AEHLAU.
   Volume(issue)/page/year: 25,199,1943

TYPE OF TEST            : Cytogenetic analysis
TEST SYSTEM             : Human Leukocyte
DOSE/DURATION           : 100 umol/L
REFERENCE :
   DBTEAD Diabete.  (Le Raincy, France)  V.1-22, 1953-74.  Discontinued.
   Volume(issue)/page/year: 19,215,1971

TYPE OF TEST            : DNA damage
TEST SYSTEM             : Mammal - species unspecified Lymphocyte
DOSE/DURATION           : 150 mmol/L
REFERENCE :
   PNASA6 Proceedings of the National Academy of Sciences of the United States
   of America.  (National Academy of Sciences, Printing & Pub. Office, 2101
   Constitution Ave., Washington, DC 20418) V.1-    1915-
   Volume(issue)/page/year: 48,686,1962

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - gerbil
DOSE                    : 315 mg/kg
SEX/DURATION            : male 21 day(s) pre-mating
TOXIC EFFECTS :
   Reproductive - Paternal Effects - spermatogenesis (incl. genetic material,
   sperm morphology, motility, and count)
   Reproductive - Paternal Effects - testes, epididymis, sperm duct
   Reproductive - Paternal Effects - prostate, seminal vesicle, Cowper's gland,
   accessory glands
REFERENCE :
   IJEBA6 Indian Journal of Experimental Biology.  (Publications & Information
   Directorate, CSIR, Hillside Rd., New Delhi 110 012, India)  V.1-    1963-
   Volume(issue)/page/year: 17,1305,1979

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 315 mg/kg
SEX/DURATION            : male 21 day(s) pre-mating
TOXIC EFFECTS :
   Reproductive - Paternal Effects - spermatogenesis (incl. genetic material,
   sperm morphology, motility, and count)
   Reproductive - Paternal Effects - testes, epididymis, sperm duct
   Reproductive - Paternal Effects - prostate, seminal vesicle, Cowper's gland,
   accessory glands
REFERENCE :
   IJEBA6 Indian Journal of Experimental Biology.  (Publications & Information
   Directorate, CSIR, Hillside Rd., New Delhi 110 012, India)  V.1-    1963-
   Volume(issue)/page/year: 17,1305,1979

其他信息

方法一:工业生产方法主要为苯酚加氢法和环己烷氧化法。1.苯酚加氢法苯酚蒸气和氢气在镍催化剂存在下，在110-185℃、压力1.078-1.471MPa，在管式反应器中进行加氢反应制得环己醇蒸气产品，经换热、冷凝、分离除氢后再精馏得成品。2.环己烷氧化法苯蒸气在镍催化剂存在下，于120-180℃进行加氢反应得环己烷，环己烷氧化制造环己醇根据不同催化剂分为以下三种方法：（1）钴盐催化法　以环烷酸钴，硬脂酸钴或辛酸钴为催化剂。（2）硼酸催化法以硼酸或偏硼酸为催化剂，在空气氧化过程中，硼酸与环己基过氧化氢生成过硼酸环己醇酯，然后再变成硼酸环己醇酯，或者与生成的环己醇结合生成硼酸环己醇酯和偏硼酸环己醇酯。然后水解，油相经提纯即得成品。（3）无催化剂氧化法以环己烷为原料，在压力1.47-1.96MPa，温度170-200℃下，用氧含量为10%-15%的空气氧化得环己基过氧化氢，再经浓缩后，于70-160℃催化分解，即得环己醇和环己酮。
急性毒性:口服- 大鼠 LD50: 2060 毫克/ 公斤; 腹注- 小鼠 LD50: 1352 毫克/ 公斤
下游产品:环己酮 --> 己二酸 --> 1,6-己内酰胺 --> 环己胺 --> 环己烯 --> (R)-3-羟基吡咯烷盐酸盐 --> 氯代环己烷 --> 溴代环己烷 --> 环己甲酸 --> 二环己基二硫化物 --> 环己硫醇 --> 过氧化二碳酸二环己酯[工业纯] --> 苯次磺
毒性分级:中毒
环己醇价格(试剂级):更新日期产品编号产品名称包装价格 2011/08/23 30046428 环己醇 500ml 39.8元 2011/08/23 40011062 环己醇 2ml 49元 2010/06/21 14768002
刺激数据:眼- 兔子 2 毫克重度; 皮肤- 兔子 14.6 毫克/ 24小时轻度
Acros Organics:环己醇 Cyclohexanol, 98%(108-93-0)
图谱信息:环己醇(108-93-0)核磁图( 13 CNMR) 环己醇(108-93-0)质谱(MS) 环己醇(108-93-0)红外图谱(IR1) 环己醇(108-93-0)红外图谱(IR2) 环己醇(108-93-0)核磁图( 1 HN
Alfa Aesar:环己醇,99% Cyclohexanol, 99%(108-93-0)
爆炸物危险特性:与空气混合可爆
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
MOL 文件:108-93-0.mol
类别:易燃液体
{C
用途三:比色法测定钼和铼，以苯肼测定铝。以8-羰基喹啉或以碘化物测定铋时作溶剂，以提取带色物质。橡胶、树脂和硝化棉溶剂。杀虫剂。
敏感性:Hygroscopic
上游原料:苯 --> 过氧化氢 --> 氢 --> 环己烷 --> 环己酮 --> 辛酸 --> 环烷酸钴 --> 偏硼酸 --> 硬脂酸钴
用途一:用于环己醇脱氢过程
储运特性:库房通风低温干燥
有似樟脑气味，有吸湿性。能与醇、乙酸乙酯、亚麻子油和芳香烃类混溶。20℃时水中溶解度为3.6g/100g,20℃时水在环己醇中的溶解度为11g/100g。低毒，半数致死量（大鼠，经口）2060mg/kg。有刺激性。
用途二:重要的化工原料，主要用于生产己二酸、己二胺、环己酮、己内酰胺，也可用作肥皂的稳定剂，制造消毒药皂和去垢乳剂，用作橡胶、树脂、硝基纤维、金属皂、油类、酯类、醚类的溶剂，涂料的掺合剂，皮革的脱脂剂、脱膜剂、干洗剂、擦亮剂。环己醇也是纤维整理剂、杀虫剂、增塑剂的原料，环己醇与光气反应得到氯甲酸环己酯，是引发剂过氧化二碳酸二环己酯的中间体。
Sigma Aldrich:108-93-0(sigmaaldrich)
职业标准:TLV-TWA 50 PPM (200 毫克/ 立方米); STEL 75 PPM (300 毫克/ 立方米)
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