1-Hydroxycyclohexanecarbonitrile 1-羟基-1-氰基环己烷

CAS 931-97-5 MFCD00003818

化学结构图

931-97-5
SMILES: N#CC1(O)CCCCC1

化学属性

Mol. FormulaC7H11NO
Mol. Weight125.17
Density1.031
Refractive index1.4690
Flash Point112.1±22.6 °C
TSCAYes
Boiling Point232.1±0.0 °C at 760 mmHg
Melting Point35 °C

别名和识别编码

Chemical Name1-Hydroxycyclohexanecarbonitrile
Synonym 1-Hydroxycyclohexanecarbonitrile {LY} 1-Hydroxycyclohexanecarbonitrile {} {LY} 1-Hydroxycyclohexanecarbonitrile {} {} {LY} 1-Hydroxycyclohexanecarbonitrile {} {} {} {LY} 1-Hydroxycyclohexanecarbonitrile {} {} {} {} {LY} 1-Hydroxycyclohexanecarbonitrile {} {} {} {} {} {LY} 1-Hydroxycyclohexanecarbonitrile {} {} {} {} {} {} {LY} 1-Hydroxycyclohexanecarbonitrile {} {} {} {} {} {} {} {LY} 1-Hydroxycyclohexanecarbonitrile {} {} {} {} {} {} {} {} {LY} 1-Hydroxycyclohexanecarbonitrile {} {} {} {} {} {} {} {} {} {LY} 1-Hydroxycyclohexanecarbonitrile {} {} {} {} {} {} {} {} {} {} {LY} 1-Hydroxycyclohexanecarbonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-Hydroxycyclohexanecarbonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-Hydroxycyclohexanecarbonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-Hydroxycyclohexanecarbonitrile {} {} {} {} {} {} {} {} {} {}
MDL NumberMFCD00003818
CAS Number931-97-5
EC Number213-246-0
PubChem Substance ID13610
Chemical Name Translation1-羟基-1-氰基环己烷
Wiswesser Line NotationL6TJ AQ ACN
Beilstein Registry Number1634973
LabNetwork Molecule IDLN00239819
InChIInChI=1S/C7H11NO/c8-6-7(9)4-2-1-3-5-7/h9H,1-5H2
Canonical SMILESN#CC1(O)CCCCC1
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分类

  • {SNA} Building Blocks, C6 to C7, Chemical Synthesis, Cyanides/Nitriles, Nitrogen Compounds, Organic Building Blocks
  • {uni_hamburg} no charge; carbocycle; alicycle; 6RingOnly; 6ring; alcohol; 1fragment

相关文献及参考

  • Short: IV/18B Title: Viscosity of Pure Organic Liquids and Binary Liquid Mixtures: Pure Organic Liquids Author: Wohlfarth, Ch.; Wohlfarth, B. Editor: Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: IV/18B Year: 2001 Keyword: organic compounds; viscosity; liquids; mixtures Internet Resource: DOI:10.1007/b68240 RefComment: VII, 409 pages.
  • Short: EINECS Title: EINECS (European Inventory of Existing Commercial Chemical Substances) Source: Official Journal of the European Communities Volume: C 146 A (15.06.1990) Page: 1 Year: 1990 Internet Resource: http://ecb.jrc.ec.europa.eu/esis/index.php?PGM=ein Publish_Date: 1990/06/15

安全信息

RTECSGU7710000
Packing GroupII
UN Number UN 2811 6.1/PG 2 UN3439
Risk Statements
  • R28 Very toxic if swallowed 吞咽极毒
  • R50/53
Safety Statements
  • S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时，立即求医（可能时出示标签）；
  • S28 After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer) 皮肤接触后，立即用大量…（由生产厂家指定）冲洗；
  • S57 Use appropriate containment to avoid environmental contamination 使用适当容器避免环境污染；
  • S20 When using do not eat or drink 使用时，不得进食，饮水；
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；
GHS Symbol
WGK Germany3
Hazard statements
  • H300 Fatal if swallowed 吞食致命
  • H310 Fatal in contact with skin 皮肤接触致命
  • H315 Causes skin irritation 会刺激皮肤
  • H318 Causes serious eye damage 严重伤害眼睛
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H330 Fatal if inhaled 吸入致命
  • H400 Verytoxictoaquaticlife 对水生生物毒性非常大。
  • H410 Verytoxictoaquaticlifewithlonglastingeffects 对水生生物毒性非常大并具有长期影响。
Personal Protective Equipment Eyeshields, Faceshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges
Precautionary statements
  • P260 Do not breathe dust/fume/gas/mist/vapours/spray. 不要吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P262 Do not get in eyes, on skin, or on clothing. 不要接触眼睛，皮肤或衣服。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P264+P265
  • 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。
  • P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
  • P273 Avoid release to the environment. 避免释放到环境中。
  • 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。
  • P284 Wear respiratory protection.? 佩戴呼吸保护装置。
  • P301+P310
  • P301+P316
  • P302+P350
  • P302+P352
  • P304+P340
  • P305+P351+P338
  • P305+P354+P338
  • P310 Immediately call a POISON CENTER or doctor/physician. 立即呼救解毒中心或医生/医师。
  • P316
  • P317
  • P320 Specific treatment is urgent (see … on this label). 紧急具体治疗（见本标签上的）。
  • P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
  • P322 Specific measures (see …on this label). 具体治疗（见本标签上的）。
  • P330 Rinse mouth. 漱口
  • P332+P313
  • P332+P317
  • P337+P313
  • P337+P317
  • P361 Remove/Take off immediately all contaminated clothing. 立即去除/脱掉所有被污染的衣服。
  • P361+P364
  • P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服，清洗后方可重新使用
  • P362+P364
  • P363 Wash contaminated clothing before reuse. 被污染的衣服洗净后方可重新使用。
  • P391 Collect spillage. Hazardous to the aquatic environment 收集对水环境有危害的泄漏物。
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word Danger
Hazard Codes T+
Hazard Class6.1 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 18 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems
   Laboratory, NIOSH Exchange Chemicals.  (Aberdeen Proving Ground, MD 21010)
   Volume(issue)/page/year: NX#04232

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 10 mg/kg
TOXIC EFFECTS :
   Behavioral - general anesthetic
   Behavioral - somnolence (general depressed activity)
   Behavioral - convulsions or effect on seizure threshold
REFERENCE :
   NTIS** National Technical Information Service.  (Springfield, VA 22161)
   Formerly U.S. Clearinghouse for Scientific & Technical Information.
   Volume(issue)/page/year: OTS0570906

Storage condition

其他信息

  • Alfa Aesar:环己酮氰醇,98% Cyclohexanone cyanohydrin, 98%(931-97-5)
  • Sigma Aldrich:931-97-5(sigmaaldrich)
  • 图谱信息:环己酮氰醇(931-97-5)质谱(MS) 环己酮氰醇(931-97-5)红外图谱(IR1) 环己酮氰醇(931-97-5)核磁图( 13 CNMR)
  • 环己酮氰醇价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2010/05/25 H26699 环己酮氰醇, 98% Cyclohexanone cyanohydrin, 98% 50g 3850元 2010/05/25 H26699 环己酮氰醇, 98% Cyclohexanone cyanohydrin, 98% 1g 252元 2010/05/25 H26699 环己酮氰醇, 98% Cyclohexanone cyanohydrin, 98% 10g 1187元
  • MOL 文件:931-97-5.mol

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Nitrogen Compounds 氮化合物
  5. Cyanides/Nitriles - Nitrogen Compounds
  6. C6 to C7 - Cyanides/Nitriles
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Nitrogen Compounds 氮化合物
  5. Cyanides/Nitriles - Nitrogen Compounds
  6. C6 to C7 - Cyanides/Nitriles

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