CAS 629-04-9 MFCD00000273-1-Bromoheptane 1-溴庚烷 TAO{mole}

1-Bromoheptane 1-溴庚烷

CAS 629-04-9 MFCD00000273

化学结构图

SMILES: CCCCCCCBr

化学属性

Mol. Formula	CH3(CH2)6Br
Mol. Weight	179
Density	1.140
Refractive index	1.4490 to 1.4510
Flash Point	60°C(lit.)
TSCA	Yes
Boiling Point	180
Melting Point	-58
Vapor Density	6.18 (vs air)
Solubility	不溶
Appearance	无色液体液体。沸点66-68℃(1.467kPa)，相对密度1.139(d4)折光率1.451。
Danger-Level	乙类

别名和识别编码

Chemical Name	1-Bromoheptane
Synonym	1-溴代庚烷 heptane,1-bromo- Heptyl bromide 1-BROMOHEPTANE 1-Heptyl bromide 1-溴庚烷 1-bromoheptane 溴代正庚烷 1-溴庚烷,98+% 1-bromo-heptane heptyl bromide 1-BROMOHEPTANE pure 正庚基嗅,溴代庚烷,1-溴代正庚烷,溴庚烷 1-Bromoheptane,98+% 1-Bromheptan n-bromoheptane 溴庚烷 heptane, 1-bromo- 正庚基溴 1-溴代正庚烷 1-Bromoheptane Heptylbromide 正庚基嗅溴代庚烷 1-bromo-heptan n-Heptyl bromide 1-Heptylbromide HEPTYL BROMIDE N-HEPTYL BROMIDE Heptyl-bromide- Heptylbromid
CAS Number	629-04-9
EC Number	211-068-8
Beilstein Registry Number	1,155
MDL Number	MFCD00000273
PubChem Substance ID	12369
Chemical Name Translation	1-溴庚烷
Reaxys-RN	1697160
InChIKey	LSXKDWGTSHCFPP-UHFFFAOYSA-N
LabNetwork Molecule ID	LN00202036
InChI	InChI=1S/C7H15Br/c1-2-3-4-5-6-7-8/h2-7H2,1H3

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产品应用

用于有机合成。

安全信息

Signal word

GHS Symbol

WGK Germany3

Safety Statements

S37/39 Wear suitable gloves and eye/face protection 穿戴适当的手套和眼睛/面保护；
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；
S23 Do not breathe gas/fumes/vapour/spray (appropriate wording to be specified by the manufacturer) 不要吸入气体/烟雾/蒸汽/喷雾；
S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；

Risk Statements

R36/37 Irritating to eyes and respiratory system 对眼睛和呼吸系统有刺激性
R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
R20 Harmful by inhalation 吸入有害

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 Use explosion-proof electrical/ventilating/lighting/…/equipment. 使用防爆电气/通风/照明/ .../设备。
P241+P242+P243
P242 Use only non-sparking tools. 只能使用无火花工具。
P243 Take precautionary measures against static discharge. 采取预防措施，防止静电放电。
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。
P264+P265
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+P312
P302+P352
P302+P352+P332+P313+P362+P364
P303+P361+P353
P305+
P305+P351+P338
P305+P351+P338+P337+P313
P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
P332+P313
P332+P317
P337+P313
P337+P317
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
P370+P378
P403+P235
P501 Dispose of contents/container to..… 处理内容物/容器.....

RTECSMI8100000

Packing GroupIII

UN Number 1993

Hazard statements

H226 Flammable liquid and vapour 易燃液体和蒸气
H315 Causes skin irritation 会刺激皮肤
H319 Causes serious eye irritation 严重刺激眼睛

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

Hazard Codes

Hazard Class3

Storage condition Store at RT.

TYPE OF TEST            : LC50 - Lethal concentration, 50 percent kill
ROUTE OF EXPOSURE       : Inhalation
SPECIES OBSERVED        : Mammal - species unspecified
DOSE/DURATION           : 12 gm/m3
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   GTPZAB Gigiena Truda i Professional'nye Zabolevaniya.  Labor Hygiene and
   Occupational Diseases. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR)
   V.1-36, 1957-1992. For publisher information, see MTPEEI
   Volume(issue)/page/year: 18(4),55,1974

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 2440 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   GTPZAB Gigiena Truda i Professional'nye Zabolevaniya.  Labor Hygiene and
   Occupational Diseases. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR)
   V.1-36, 1957-1992. For publisher information, see MTPEEI
   Volume(issue)/page/year: 20(12),52,1976

其他信息

TCI Shanghai:1-溴庚烷 1-Bromoheptane,>;98.0%(GC)(629-04-9)
用途二:用作有机合成中间体
Alfa Aesar:1-溴庚烷,98+% 1-Bromoheptane, 98+%(629-04-9)
Acros Organics:1-溴庚烷 1-Bromoheptane, 99%(629-04-9)
MOL 文件:629-04-9.mol
图谱信息:1-溴代庚烷(629-04-9)红外图谱(IR2) 1-溴代庚烷(629-04-9)红外图谱(IR1) 1-溴代庚烷(629-04-9)质谱(MS) 1-溴代庚烷(629-04-9)核磁图( 1 HNMR) 1-溴代庚烷(629-04-9)Raman光谱 1-溴代庚烷(629-04-9)核磁图( 13 CNMR)
海关编码:29033036
不溶于水,溶于乙醇、乙醚等有机溶剂。可水解为正庚醇，氨解为正庚胺。与镁在干燥乙醚反应生成格利雅试剂,通过武尔茨反应(Wtirtz reaction)生成正十四烷。
下游产品:壬酸 --> 四庚基溴化铵 --> 庚烷磺酸钠一水合物(HPLC级) --> 1-庚烷磺酸钠 --> 甲酸庚酯
MSDS 信息:1-Bromoheptane(629-04-9).msds
用途一:用作溶剂，也用于有机合成
蒸气密度:6.18 (vs air)
Sigma Aldrich:629-04-9(sigmaaldrich)
1-溴代庚烷价格(试剂级):更新日期产品编号产品名称包装价格 2011/08/23 30026824 1-溴代庚烷 25ml 41元 2011/08/23 30026825 1-溴代庚烷 50ml 88元 2011/04/16 B0598 1-溴庚烷 1-Bromoheptane 25G 135元