CAS 110-52-1 MFCD00000261-1,4-Dibromobutane 1,4-二溴丁烷 TAO{mole}

1,4-Dibromobutane 1,4-二溴丁烷

CAS 110-52-1 MFCD00000261

化学结构图

SMILES: BrCCCCBr

化学属性

Mol. Formula	C4H8Br2
Mol. Weight	215.91
Density	1.808
Refractive index	1.5170 to 1.5210
Boiling Point	63-65°C at 760 mmHg
Melting Point	-20°C
Flash Point	110°C
TSCA	Yes
Solubility	不溶于水。
Stability	对光和空气敏感
Appearance	无色或微黄色液体。熔点-16.53℃（-20℃），沸点197-198℃（1.46kPa），76℃（1.47kPa），相对密度1.7890（20/4℃），折射率1.5190，闪点54℃。溶于氯仿、醇和醚，不溶于水。
Danger-Level	-
pH	-:-
Redox	-

别名和识别编码

Chemical Name	1,4-二溴丁烷粗品
CAS Number	110-52-1
Alfabeta Name	DIBROMOBUTANE 14-,
MDL Number	MFCD00000261
EC Number	203-775-5
Beilstein Registry Number	1071199
Synonym	1,4-Dibromobutane {LY} 1,4-Dibromobutane {} {LY} 1,4-Dibromobutane {} {} {LY} 1,4-Dibromobutane {} {} {} {LY} 1,4-Dibromobutane {} {} {} {} {LY} 1,4-Dibromobutane {} {} {} {} {} {LY} 1,4-Dibromobutane {} {} {} {} {} {} {LY} 1,4-Dibromobutane {} {} {} {} {} {} {} {LY} 1,4-Dibromobutane {} {} {} {} {} {} {} {} {LY} 1,4-Dibromobutane {} {} {} {} {} {} {} {} {} {LY} 1,4-Dibromobutane {} {} {} {} {} {} {} {} {} {} {LY} 1,4-Dibromobutane {} {} {} {} {} {} {} {} {} {} {} {LY} 1,4-Dibromobutane {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,4-Dibromobutane {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,4-Dibromobutane {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,4-Dibromobutane {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,4-Dibromobutane {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,4-Dibromobutane {} {} {} {} {} {} {} {} {} {}
PubChem Substance ID	8056
Chemical Name Translation	1,4-二溴丁烷
Reaxys-RN	1071199
Wiswesser Line Notation	E4E
LabNetwork Molecule ID	LN00120520
InChI	InChI=1S/C4H8Br2/c5-3-1-2-4-6/h1-4H2
Canonical SMILES	BrCCCCBr

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产品应用

1,4-Dibromo butane was used to investigate the metabolism of two halopropanes: 1,3-dichloropropane and 2,2-dichloropropane. It was used as reagent during the synthesis of diazadioxa oxovanadium(IV) macrocyclic complexes.

安全信息

Warnings IRRITANT

Signal word

GHS Symbol

WGK Germany2

Safety Statements

S39 Wear eye/face protection 戴眼睛/面孔保护装置；
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；
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）；
S37 Wear suitable gloves 戴适当手套；

Risk Statements

R41 Risk of serious damage to eyes 有严重损伤眼睛的危险
R25 Toxic if swallowed 吞咽有毒
R37/38 Irritating to respiratory system and skin 对呼吸系统和皮肤有刺激性
R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性

Precautionary statements

P304+P340+P312
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
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。
P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
P305+P351+P338
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。
P332+P313
P201 Obtain special instructions before use. 使用前获取专门指示。
P501 Dispose of contents/container to..… 处理内容物/容器.....
P405 Store locked up. 上锁保管。
P301+P310
P403+P233
P202 Do not handle until all safety precautions have been read and understood. 已阅读并理解所有的安全预防措施之前，切勿操作。

Hazard statements

H315 Causes skin irritation 会刺激皮肤
H318 Causes serious eye damage 严重伤害眼睛
H412 Harmfutoaquaticlifewithlonglastingeffects 对水生生物有害并具有长期影响。
H301 Toxic if swallowed 吞食有毒
H335 May cause respiratory irritation 可能导致呼吸道刺激

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

RTECSEJ7565000

Hazard Codes T T,Xi,C T;Xi

UN Number

Storage condition Store at room temperature {LY} Store at room temperature {} {LY} Store at room temperature {} {} {LY} Store at room temperature {} {} {} {LY} Store at room temperature {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

Packing GroupIII

Hazard Class6.1(b)

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 300 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   ARZNAD Arzneimittel-Forschung. Drug Research.  (Editio Cantor Verlag,
   Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.)  V.1-    1951-
   Volume(issue)/page/year: 14,668,1964

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Salmonella typhimurium
DOSE/DURATION           : 10 umol/plate
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 141,11,1984

Restrict -

其他信息

Acros Organics:1,4-二溴丁烷 1,4-Dibromobutane, 99%(110-52-1)
MSDS 信息:1,4-Dibromobutane(110-52-1).msds
图谱信息:1,4-二溴丁烷(110-52-1)红外图谱(IR2) 1,4-二溴丁烷(110-52-1)红外图谱(IR1) 1,4-二溴丁烷(110-52-1)核磁图( 13 CNMR) 1,4-二溴丁烷(110-52-1)质谱(MS) 1,4-二溴丁烷(110-52-1)核磁图( 1 HNMR) 1,4-二溴丁烷(110-52-1)Raman光谱
下游产品:1,4-双(二苯基膦)丁烷 --> 1-苯基环戊烷羧酸 --> 4-吡咯烷丁胺 --> 盐酸丁螺环酮 --> 1-溴-4-甲氧基丁烷 --> 喷托维林 --> 1-(4-甲氧基丁基)肼 --> 4-(1-吡咯啉基)苯甲醛 --> 1-苯基-1-氰基环戊烷 --> Α-苯基环戊烷甲酰氯 --> 双芬麦兰 --> 4-苯氧基丁酸 --> 1-苯基吡咯烷
Sigma Aldrich:110-52-1(sigmaaldrich)
方法一:1.由四氢呋喃经开环、溴化而得。反应锅中加入氢溴酸，在搅拌下滴加四氢呋喃，再滴加硫酸，温度控制在50℃以下。然后升温至108℃左右回流4h，反应完毕后继续搅拌1h，放冷分取下层液，用纯碱溶液洗至中性，加无水氯化钙干燥，过滤得成品。2.由1,4-丁二醇溴化而得。将氢溴酸加入反应锅内，搅拌冷至10℃，滴加硫酸。加毕，再滴加1,4-丁二醇，温度不超过15℃，搅拌半小时。在100-110℃下保温6h。冷至室温，分取下层液，用纯碱溶液洗至中性。氯化钙脱水后，过滤得1,4-二溴丁烷。
用途二:用于有机合成
TCI Shanghai:1,4-二溴丁烷 1,4-Dibromobutane,>;98.0%(GC)(110-52-1)
不溶于水。
用途一:医药上用于制造氨茶碱、咳必清等
海关编码:29033036
用途三:有机合成中间体，用于制造氨茶碱、咳必清、驱蛲净等。
MOL 文件:110-52-1.mol
1,4-二溴丁烷价格(试剂级):更新日期产品编号产品名称包装价格 2011/08/23 30053126 1，4-二溴丁烷;溴化四亚甲基; 亚丁基二溴 100ml 94元 2011/04/16 D0176 1,4-二溴丁烷 1,4-Dibromobutane 25G 180元 2011/04/16 D0176 1,4-二溴丁烷 1,4-Dibromobutane 500G 840元
上游原料:四氢呋喃 --> 1,4-丁二醇
Solubility in water: immiscible Solubility in other solvents: soluble in all usual organic solvents and alcohols soluble in chloroform
Alfa Aesar:1,4-二溴丁烷,99% 1,4-Dibromobutane, 99%(110-52-1)