CAS 873-32-5 MFCD00001779-2-Chlorobenzonitrile 邻氯苯腈 TAO{mole}

2-Chlorobenzonitrile 邻氯苯腈

CAS 873-32-5 MFCD00001779

化学结构图

SMILES: N#Cc1ccccc1Cl

化学属性

Mol. Formula	C7H4ClN
Mol. Weight	137.57
Flash Point	122°C
TSCA	Yes
Melting Point	43-46°C
Boiling Point	232°C at 760 mmHg
Density	1.18
Appearance	针状结晶。熔点43-46℃，沸点232℃，闪点108℃。溶于乙醚、乙醇。

别名和识别编码

Chemical Name	2-Chlorobenzonitrile
MDL Number	MFCD00001779
Synonym	2-Chlorobenzonitrile {LY} 2-Chlorobenzonitrile {} {LY} 2-Chlorobenzonitrile {} {} {LY} 2-Chlorobenzonitrile {} {} {} {LY} 2-Chlorobenzonitrile {} {} {} {} {LY} 2-Chlorobenzonitrile {} {} {} {} {} {LY} 2-Chlorobenzonitrile {} {} {} {} {} {} {LY} 2-Chlorobenzonitrile {} {} {} {} {} {} {} {LY} 2-Chlorobenzonitrile {} {} {} {} {} {} {} {} {LY} 2-Chlorobenzonitrile {} {} {} {} {} {} {} {} {} {LY} 2-Chlorobenzonitrile {} {} {} {} {} {} {} {} {} {} {LY} 2-Chlorobenzonitrile {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Chlorobenzonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Chlorobenzonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Chlorobenzonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Chlorobenzonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Chlorobenzonitrile {} {} {}
EC Number	212-836-5
CAS Number	873-32-5
Beilstein Registry Number	1363916
PubChem Substance ID	13391
Reaxys-RN	1363916
Chemical Name Translation	邻氯苯腈
InChIKey	NHWQMJMIYICNBP-UHFFFAOYSA-N
Wiswesser Line Notation	NCR BG
LabNetwork Molecule ID	LN00008367
InChI	InChI=1S/C7H4ClN/c8-7-4-2-1-3-6(7)5-9/h1-4H
Canonical SMILES	N#CC1=CC=CC=C1Cl

信息真实价格透明资金保障专业采购外包团队在线服务

品牌质保精细包装现货库存一流品牌服务

产品应用

有机合成中间体。

安全信息

RTECSDI2625000

Safety Statements

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；

UN Number 3439 UN3439

Risk Statements

R21/22 Harmful in contact with skin and if swallowed 皮肤接触和不慎吞咽有害
R36 Irritating to eyes 刺激眼睛
R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性

Signal word Warning

GHS Symbol

WGK Germany2

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。
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。
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+P312+P330
P302+P352+P312+P362+P364
P305+P351+P338
P305+P351+P338+P337+P313
P332+P313
P501 Dispose of contents/container to..… 处理内容物/容器.....

Packing GroupIII

Hazard statements

H302+H312
H302 Harmful if swallowed 吞食有害
H312 Harmful in contact with skin 皮肤接触有害
H319 Causes serious eye irritation 严重刺激眼睛

Personal Protective Equipment dust mask type N95 (US), Eyeshields, Faceshields, Gloves

Hazard Codes Xn Xn,Xi

Hazard Class6.1

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : >300 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JMCMAR Journal of Medicinal Chemistry.  (American Chemical Soc.,
   Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC
   20037)  V.6-    1963-  Volume(issue)/page/year: 21,906,1978

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 150 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NTIS** National Technical Information Service.  (Springfield, VA 22161)
   Formerly U.S. Clearinghouse for Scientific & Technical Information.
   Volume(issue)/page/year: AD691-490

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 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

其他信息

检测方法:GC
Hazard Note:Harmful/Irritant
溶于乙醚、乙醇；不溶于水。
Alfa Aesar:2-氯苯甲腈,98% 2-Chlorobenzonitrile, 98%(873-32-5)
图谱信息:邻氯苯腈(873-32-5)核磁图( 13 CNMR) 邻氯苯腈(873-32-5)核磁图( 1 HNMR) 邻氯苯腈(873-32-5)质谱(MS) 邻氯苯腈(873-32-5)Raman光谱邻氯苯腈(873-32-5)红外图谱(IR1) 邻氯苯腈(873-32-5)红外图谱(IR2)
Sigma Aldrich:873-32-5(sigmaaldrich)
用途二:有机合成中间体。主要用于合成染料中间体2-氰基-4-硝基苯胺，医药工业用于合成抗疟疾新药硝喹等。
海关编码:29269095
可燃性危险特性:遇热可燃;热分解, 或与水, 水蒸气, 酸, 酸雾接触排出有毒氮氧化物, 氯化物, 氰化物烟雾
邻氯苯腈价格(试剂级):更新日期产品编号产品名称包装价格 2014/06/02 C1130 2-氯苯甲腈 2-Chlorobenzonitrile 500G 980元 2014/06/02 C1130 2-氯苯甲腈 2-Chlorobenzonitrile 25G 195元 2010/06/21 108672500 邻氯苯腈 2-Chlorobenzonitrile 99% 250 GR 722元
刺激数据:眼睛-兔 100 毫克/24小时中度
用途一:用于染料、医药及其他精细化工中间体
MOL 文件:873-32-5.mol
类别:有毒物质
上游原料:2-氯苯甲酸 --> 氨基磺酸
TCI Shanghai:2-氯苯甲腈 2-Chlorobenzonitrile,>;98.0%(GC)(873-32-5)
Acros Organics:2-氯苯甲腈 2-Chlorobenzonitrile, 99%(873-32-5)
急性毒性:口服-小鼠 LD50: >; 300 毫克/公斤; 腹腔-小鼠 LD50: 150 毫克/公斤
下游产品:2-苯基苄胺 --> 2-氯-5-硝基苯甲腈 --> 2-氰基-4-硝基苯胺
方法一:由邻氯苯甲酸与尿素反应而得：将邻氯苯甲酸、氨基磺酸和尿素混合后加热至140℃左右熔融，在搅拌下剧烈反应，并放出大量气体，温度自动上升至220-230℃，反应2h。然后冷却至15℃以下，过滤，所得固体分别用3%氨水和水洗至中性，再经干燥而得成品。
毒性分级:高毒
MSDS 信息:OCBN(873-32-5).msds
储运特性:库房低温通风干燥; 防水, 防潮, 与酸, 氧化剂, 食品原料分开存放
灭火剂:二氧化碳, 泡沫, 干粉