1-Chlorobutane 1-氯丁烷

CAS 109-69-3 MFCD00001009

化学结构图

109-69-3
SMILES: CCCCCl

化学属性

Mol. FormulaC4H9Cl
Mol. Weight92.57
Refractive index1.4010 to 1.4030
Boiling Point77-78
Density0.886
Melting Point-123
Flash Point-13°C(lit.)
TSCAYes
Autoignition Point860 °F
Vapor Density3.2 (vs air)
Vapor Pressure80.1 mmHg ( 78.4 °C)
Solubility不溶于水,可混溶于乙醇、乙醚等多数有机溶剂。

别名和识别编码

Chemical Name1-Chlorobutane
Synonym 1-chloro-butan 1-chloro-butane 1-氯丁烷 1-氯丁烷, HPLC GRADE, 99.5+% BUTYL CHLORIDE Butyl chloride C4H9Cl (1-chloro-butane) N-BUTYL CHLORIDE N-PROPYLCARBINYL CHLORIDE N-butyl chloride butane, 1-chloro- chloruredebutyle n-C4H9Cl 丁基氯 氯丁烷 氯代正丁基 氯代正丁烷
CAS Number109-69-3
PubChem Substance ID8005
EC Number203-696-6
Beilstein Registry Number1730909
MDL NumberMFCD00001009
Reaxys-RN1730909
Merck Number1560
Chemical Name Translation1-氯丁烷
Wiswesser Line NotationG4
LabNetwork Molecule IDLN00163237
InChIInChI=1S/C4H9Cl/c1-2-3-4-5/h2-4H2,1H3
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分类

  • {SNA} Biotech Solvents, Solvent Bottles, Solvent P
  • {SNA} Amber Glass Bottles,
  • {Chemicalbook} 农药中间体: 杀菌剂中间体: 三唑类杀菌剂
  • {SNA} Alkyl
  • {SNA} Anhydrous Solvents, Solvent Bottles, Solvent Packaging Options, Solvent by Application, Solvents, Sure/Seal Bottles
  • Amber Glass Bottles, Analytical Reagents, Analytical/Chromatography, CHROMASOLV for HPLC, Chromatography Reagents & Solvents, HPLC & UHPLC Solvents (CHROMASOLV), HPLC Grade Solvents (CHROMASOLV), HPLC/UHPLC Solvents (CHROMASOLV), Solvent Bottles, Solvent Packaging Options, Solvent by Application, Solvents
  • {SNA} Amber Glass Bottles, CHROMASOLV for HPLC, Chromatography Reagents & Solvents, HPLC & UHPLC Solvents (

产品应用

  • 有机合成。制备丁基纤维素的丁基化剂。溶剂。

相关文献及参考

  • Merck:14,1560 Beilstein:1(4)246
  • Merck:14,1560
  • Short: II/14a
  • Short: II/2
  • Short: II/24B
  • The Grignard reagent has been recommended as superior to EtMgBr for the preparation of ethynyl magnesium halides from acetylene. For details, see: Org. Synth. Coll., 8, 606 (1993); for generation and use of the Grignard in the Mn-Cu catalyzed 1,4-addition to an enone, see: Org. Synth. Coll., 9, 328 (1998).

安全信息

GHS Symbol
WGK Germany2
Hazard Codes 3 F
Hazard statements
  • H225 Highly flammable liquid and vapour 高度易燃液体和蒸气
  • H412 Harmfutoaquaticlifewithlonglastingeffects 对水生生物有害并具有长期影响。
  • H304 May be fatal if swallowed and enters airways 吞食和进入呼吸道可能致命
Personal Protective Equipment Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
RTECSEJ6300000
Precautionary statements
  • P201 Obtain special instructions before use. 使用前获取专门指示。
  • 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。
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • 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。
  • P301+P310
  • P303+P361+P353
  • P305+P351+P338
  • P331 Do NOT induce vomiting.. 不要催吐。
  • P332+P313
  • 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
  • P370+P378
  • P403+P235
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word Danger
Safety Statements
  • S16 Keep away from sources of ignition - No smoking 远离火源,禁止吸烟;
  • S29 Do not empty into drains 不要排入下水道;
  • S9 Keep container in a well-ventilated place 保持容器在通风良好的场所;
Risk Statements
  • R11 Highly flammable 非常易燃
  • R52/53
UN Number 1127 UN 1127 3/PG 2 UN1127
Packing GroupII
Storage condition 密封阴凉保存。 2-8°C
Hazard Class3
Warnings 危化品目录(2015) 危险化学品
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Unreported
SPECIES OBSERVED        : Rodent - guinea pig
DOSE/DURATION           : 8 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   VRDEA5 Vrachebnoe Delo.  Medical Practice.  (V/O Mezhdunarodnaya Kniga,
   113095 Moscow, USSR) No.1-    1918-  Volume(issue)/page/year: (7),105,1979

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 2670 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   AMIHBC AMA Archives of Industrial Hygiene and Occupational Medicine.
   (Chicago, IL)  V.2-10, 1950-54. For publisher information, see AEHLAU.
   Volume(issue)/page/year: 10,61,1954

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Unreported
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 5600 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   GISAAA Gigiena i Sanitariya.  For English translation, see HYSAAV.  (V/O
   Mezhdunarodnaya Kniga, 113095 Moscow, USSR)  V.1-    1936-
   Volume(issue)/page/year: 44(3),11,1979

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - rabbit
DOSE/DURATION           : 20 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   34ZIAG "Toxicology of Drugs and Chemicals," Deichmann, W.B., New York,
   Academic Press, Inc., 1969  Volume(issue)/page/year: -,745,1969

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Unreported
SPECIES OBSERVED        :

TYPE OF TEST            : Mutation in mammalian somatic cells
TEST SYSTEM             : Rodent - mouse Lymphocyte
DOSE/DURATION           : 500 mg/L
REFERENCE :
   NTPTR* National Toxicology Program Technical Report Series.  (Research
   Triangle Park, NC 27709) No.206-  Volume(issue)/page/year: NTP-TR-312,1986

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 13927 mg/kg
SEX/DURATION            : female 1-19 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Effects on Embryo or Fetus - fetal death
REFERENCE :
   GISAAA Gigiena i Sanitariya.  For English translation, see HYSAAV.  (V/O
   Mezhdunarodnaya Kniga, 113095 Moscow, USSR)  V.1-    1936-
   Volume(issue)/page/year: 44(3),11,1979

其他信息

  • Sigma Aldrich:109-69-3(sigmaaldrich)
  • TCI Shanghai:1-氯正丁烷 1-Chlorobutane,>;98.0%(GC)(109-69-3)
  • 下游产品:正丁基锂 --> 3-(4-甲氧基-6-甲基-1,3,5-三嗪-2-基)-1-(2-甲氧基甲酰基苯基)磺酰脲 --> 正丁胺 --> 6-溴吡啶-2-甲醛 --> 叔丁基苯 --> 氧化二乙酰丙酮合钒 --> 腈菌唑 --> 2-正丁基-2-苯基-3-(1H-咪唑-1-基)丙腈 --> Α-丁基-Α-苯基-1H-咪唑-1-丙腈 --> 二丁基氧化锡 --> 正丁基丙二酸二乙酯 --> 三丁基氧化锡 --> 1,4-二氯丁烷 --> 1-正丁基-1-甲基吡咯烷二(三氟甲基磺酰)酰亚胺,98% -
  • 图谱信息:1-氯丁烷(109-69-3)核磁图( 13 CNMR) 1-氯丁烷(109-69-3)红外图谱(IR2) 1-氯丁烷(109-69-3)质谱(MS) 1-氯丁烷(109-69-3)核磁图( 1 HNMR) 1-氯丁烷(109-69-3)红外图谱(IR1)
  • 上游原料:盐酸 --> 正丁醇 --> 氯化锌
  • 灭火剂:干粉、二氧化碳、泡沫, 水雾
  • 方法二:由正丁醇与氯化氢反应而得:正丁醇和浓盐酸在氯化锌存在下加热回流反应,将反应物用水洗涤、干燥,分馏,收集75-78.5℃馏分即为成品。原料消耗定额:正丁醇(95%)1600kg/t、盐酸(30%)2780kg/t。
  • {Chemicalb
  • 蒸气压:80.1 mm Hg (
  • 用途五:在医药工业中,用作合成动物驱虫剂和保泰松药物的原料,在有机合成中,用作合成月桂酸二丁基铝、丁基纤维素等的原料。另
  • 毒性分级:中毒
  • 用途二:用作溶剂,也用于有机合成
  • 可燃性危险特性:遇明火、高温、氧化剂易燃; 遇热分解有毒光气; 燃烧产生有毒氯化物烟雾
  • 类别:易燃液体
  • 用途六:109-69-3(1-氯丁烷)用于制备烯烃聚合催化剂——丁基锂,格氏反应:制备丁基锡类产品,1-氯丁烷(109-69-3)在医药制备保泰松,农药方面:制备杀虫剂腈菌唑等聚醚生产作溶剂
  • Alfa Aesar:1-氯丁烷,HPLCGrade,99.5+% 1-Chlorobutane, HPLC Grade, 99.5+%(109-69-3)
  • 用途七:有机合成。制备丁基纤维素的丁基化剂。溶剂。
  • 方法一:其制备方法是将丁醇与氯化氢在催化剂ZnCl 2 存在下进行反应,反应结束后洗涤、干燥、分馏得产品。反应方程式:CH 3 CH 2 CH 2 CH 2 OH+HCl[ZnCl 2 ]→CH 3 CH 2 CH 2 CH 2 Cl+H 2 O
  • 用途三:用作溶剂及有机合成中丁基化试剂,还可用于制造丁基纤维素、驱虫剂及赛璐珞、保泰松等
  • 职业标准:TWA 1.5 毫克/立方米; STEL 1.5 毫克/ 立方米
  • Acros Organics:1-氯丁烷 1-Chlorobutane, 99+%(109-69-3)
  • 用途一:用于油脂、橡胶、天然树脂溶剂、医药中间体、助催化剂等
  • 能与乙醇和乙醚混溶,几乎不溶于水,溶解度: 0.5 g/l水 (20°C)。易燃
  • 急性毒性:口服- 大鼠 LD50: 2670 毫克/ 公斤; 未报-小鼠 LD50: 5600 毫克/公斤
  • 1-氯丁烷价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/08/23 80024890 氯代正丁烷 500ml 470元 2011/08/23 80024826 氯代正丁烷 100ml 44.5元 2011/08/23 FB429401 氯代正丁烷 4L 1780元
  • 储运特性:库房通风低温干燥; 与氧化剂、酸类分开存放
  • 爆炸物危险特性:与空气混合可爆; 与二价金属反应生成爆炸产物.

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