1-Hexyn-3-Ol 1-己炔-3-醇

CAS 105-31-7 MFCD00014408

化学结构图

105-31-7
SMILES: C#CC(O)CCC

化学属性

Mol. FormulaC6H10O
Mol. Weight98.15
Refractive index1.4340 to 1.4370
Boiling Point140.3±8.0 °C at 760 mmHg
Density0.873
Flash Point42.7±8.2 °C
TSCAYes
Solubility溶于水,可混溶于多数有机溶剂。
Melting Point-80 °C

别名和识别编码

Chemical Name1-Hexyn-3-Ol
CAS Number105-31-7
PubChem Substance ID87570585
EC Number203-286-7
MDL NumberMFCD00014408
Reaxys-RN1739419
Synonym Hex-1-yn-3-ol {LY} Hex-1-yn-3-ol {} {LY} Hex-1-yn-3-ol {} {} {LY} Hex-1-yn-3-ol {} {} {} {LY} Hex-1-yn-3-ol {} {} {} {} {LY} Hex-1-yn-3-ol {} {} {} {} {} {LY} Hex-1-yn-3-ol {} {} {} {} {} {} {LY} Hex-1-yn-3-ol {} {} {} {} {} {} {} {LY} Hex-1-yn-3-ol {} {} {} {} {} {} {} {} {LY} Hex-1-yn-3-ol {} {} {} {} {} {} {} {} {} {LY} Hex-1-yn-3-ol {} {} {} {} {} {} {} {} {} {} {LY} Hex-1-yn-3-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Hex-1-yn-3-ol {} {} {} {} {} {} {} {} {} {} {} {} {LY} Hex-1-yn-3-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Hex-1-yn-3-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Hex-1-yn-3-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Hex-1-yn-3-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Hex-1-yn-3-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} He
Beilstein Registry Number1739419
Chemical Name Translation1-己炔-3-醇
Wiswesser Line NotationQY3&1UU1
InChIKeyLTFTWJYRQNTCHI-UHFFFAOYSA-N
LabNetwork Molecule IDLN01322369
Canonical SMILESC#CC(O)CCC
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分类

  • Alkynes, Building Blocks, Chemical Synthesis, Organic Building Blocks, Terminal
  • {SNA} Alkynes, Building Blocks, Chemical Synthesis, Organic Building Blocks, Terminal

安全信息

GHS Symbol
WGK Germany3
Hazard Codes 6.1 T+
Hazard statements
  • H226 Flammable liquid and vapour 易燃液体和蒸气
  • H318 Causes serious eye damage 严重伤害眼睛
  • H310 Fatal in contact with skin 皮肤接触致命
  • H301 Toxic if swallowed 吞食有毒
Personal Protective Equipment Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
RTECSMR0181000
Precautionary statements
  • P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking. 远离热源/火花/明火/热的表面。——禁止吸烟。
  • P233 Keep container tightly closed. ?保持容器密闭。
  • P240 Ground/bond container and receiving equipment. 与地面接触/连接集装箱和接受设备。
  • P241+P242+P243
  • 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。
  • 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。
  • 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。
  • P301+P310+P330
  • P302+P350
  • P302+P352+P310+P361+P364
  • P303+P361+P353
  • P305+P351+P338
  • P305+P351+P338+P310
  • P310 Immediately call a POISON CENTER or doctor/physician. 立即呼救解毒中心或医生/医师。
  • P332+P313
  • P361 Remove/Take off immediately all contaminated clothing. 立即去除/脱掉所有被污染的衣服。
  • P370+P378
  • P403+P235
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word Danger
UN Number 2929
Risk Statements
  • R10 Flammable 易燃
  • R25 Toxic if swallowed 吞咽有毒
  • R27 Very toxic in contact with skin 与皮肤接触极毒
  • R41 Risk of serious damage to eyes 有严重损伤眼睛的危险
Safety Statements
  • S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后,立即用大量水冲洗并征求医生意见;
  • 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;
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套;
  • S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护;
  • 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);
Packing GroupI
Hazard Class6.1/3
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - rabbit
DOSE/DURATION           : 15800 ug/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   38MKAJ "Patty's Industrial Hygiene and Toxicology," 3rd rev. ed., Clayton,
   G.D., and F.E. Clayton, eds., New York, John Wiley & Sons, Inc., 1978-82.
   Vol. 3 originally pub. in 1979; pub. as 2nd rev. ed. in 1985.
   Volume(issue)/page/year: 2C,4675,1982

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 56 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#00219

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 126 mg/kg
TOXIC EFFECTS :
   Liver - other changes
   Kidney, Ureter, Bladder - other changes
REFERENCE :
   38MKAJ "Patty's Industrial Hygiene and Toxicology," 3rd rev. ed., Clayton,
   G.D., and F.E. Clayton, eds., New York, John Wiley & Sons, Inc., 1978-82.
   Vol. 3 originally pub. in 1979; pub. as 2nd rev. ed. in 1985.
   Volume(issue)/page/year: 2C,4674,1982

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 210 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   THERAP Therapie.  (Doin, Editeurs, 8, Place de l'Odeon, F-75006 Paris,
   France)  V.1-

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

其他信息

  • TCI Shanghai:1-己炔-3-醇 1-Hexyn-3-ol,>;95.0%(GC)(105-31-7)
  • 下游产品:叶醇
  • MSDS 信息:己炔醇(105-31-7).msds
  • 外观性质:淡黄色液体。
  • MOL 文件:105-31-7.mol
  • Sigma Aldrich:105-31-7(sigmaaldrich)
  • 图谱信息:1-己炔-3-醇 (105-31-7)核磁图( 13 CNMR) 1-己炔-3-醇 (105-31-7)核磁图( 1 HNMR) 1-己炔-3-醇 (105-31-7)红外图谱(IR1) 1-己炔-3-醇 (105-31-7)质谱(MS)
  • Alfa Aesar:1-己炔-3-醇,97% 1-Hexyn-3-ol, 97%(105-31-7)

系列性分类