CAS 619-72-7 MFCD00007279-4-Nitrobenzonitrile 4-硝基苯腈 -LabNovo

4-Nitrobenzonitrile 4-硝基苯腈

CAS 619-72-7 MFCD00007279

化学结构图

SMILES: N#Cc1ccc([N+](=O)[O-])cc1

化学属性

Mol. Formula	C7H4N2O2
Mol. Weight	148
Density	1.31
Melting Point	144-147
TSCA	T
Appearance	叶状体结晶。熔点149℃。溶于氯仿醋酸和热乙醇，微溶于水和乙醚。能升华随水蒸气挥发。

别名和识别编码

Chemical Name	4-Nitrobenzonitrile
CAS Number	619-72-7
Alfabeta Name	NITROBENZONITRILE 4-
MDL Number	MFCD00007279
Synonym	1-Nitro-4-cyanobenzene; p-Nitrobenzonitrile 1-nitro-4-cyanobenzene 4-Cyano-1-nitrobenzene 4-Cyanonitrobenzene 4-NITROBENZONITRILE AKOS B004099 Benzonitrile, p-nitro- Benzonitrile,4-nitro- P-Nitro 硝基呋喃
EC Number	210-610-0
Beilstein Registry Number	972078
PubChem Substance ID	87573551
Reaxys-RN	972078
Chemical Name Translation	4-硝基苯腈
InChIKey	NKJIFDNZPGLLSH-UHFFFAOYSA-N
Wiswesser Line Notation	WNR DCN
LabNetwork Molecule ID	LN00174745
InChI	InChI=1S/C7H4N2O2/c8-5-6-1-3-7(4-2-6)9(10)11/h1-4H

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品牌质保精细包装现货库存一流品牌服务

安全信息

Warnings IRRITANT

Signal word Danger

GHS Symbol

WGK Germany3

Safety Statements

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）；

Risk Statements

R23/24/25 Toxic by inhalation, in contact with skin and if swallowed 吸入，皮肤接触及吞食都有毒
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

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+P310
P301+P310+P330
P302+P350
P302+P352+P332+P313+P362+P364
P304+P340
P305+P351+P338
P305+P351+P338+P337+P313
P311 Call a POISON CENTER or doctor/physician. 呼叫解毒中心或医生/医师。
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
P405 Store locked up. 上锁保管。
P501 Dispose of contents/container to..… 处理内容物/容器.....

Hazard statements

H311+H331
H300 Fatal if swallowed 吞食致命

RTECSDI4903500

Personal Protective Equipment Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges

Packing GroupII

UN Number 2811 3439 UN 2811 6.1/PG 2

Hazard Codes 6.1 T

Hazard Class6.1

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 30 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   ZAARAM Zentralblatt fuer Arbeitsmedizin und Arbeitsschutz.  (Darmstadt, Fed.
   Rep. Ger.)  V.1-25, 1951-75.  Volume(issue)/page/year: 19,225,1969

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 100 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   ZAARAM Zentralblatt fuer Arbeitsmedizin und Arbeitsschutz.  (Darmstadt, Fed.
   Rep. Ger.)  V.1-25, 1951-75.  Volume(issue)/page/year: 19,225,1969

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 140 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   APFRAD Annales Pharmaceutiques Francaises.  (SPPIF, B.P.22, F-41353 Vineuil,
   France)  V.1-    1943-  Volume(issue)/page/year: 41,391,1983

TYPE OF TEST            : DNA repair
TEST SYSTEM             : Bacteria - Bacillus subtilis
DOSE/DURATION           : 50 ug/disc
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 170,11,1986

其他信息

MSDS 信息:4-Nitrobenzonitrile(619-72-7).msds
对硝基苯甲腈价格(试剂级):更新日期产品编号产品名称包装价格 2011/08/23 xw010233 4-硝基苯腈 25g 350元 2011/04/16 N0172 4-硝基苄腈 4-Nitrobenzonitrile 25G 545元 2011/04/16 N0172 4-硝基苄腈 4-Nitrobenzonitrile 250G 3100元
上游原料:对硝基苯甲酸 --> 对甲苯磺酰胺
Alfa Aesar:4-硝基苯腈,97% 4-Nitrobenzonitrile, 97%(619-72-7)
用途一:用作医药中间体
MOL 文件:619-72-7.mol
Sigma Aldrich:619-72-7(sigmaaldrich)
Acros Organics:4-硝基苯腈 4-Nitrobenzonitrile, 97%(619-72-7)
方法一:将对硝基苯甲酸对甲苯磺酰胺搅拌混合，缓缓升温，于225-230℃下反应。将反应物倾入水中，过滤，洗涤，干燥即得对硝基苯腈。收率82%。
海关编码:29269095
下游产品:4-氨基苯甲脒二盐酸盐 --> 4,4’-二脒基重氮氨基苯二乙尿酸 --> 4-硝基苄眯盐酸盐
TCI Shanghai:4-硝基苄腈 4-Nitrobenzonitrile,>;98.0%(GC)(619-72-7)
图谱信息:对硝基苯甲腈(619-72-7)红外图谱(IR3) 对硝基苯甲腈(619-72-7)核磁图( 13 CNMR) 对硝基苯甲腈(619-72-7)Raman光谱对硝基苯甲腈(619-72-7)质谱(MS) 对硝基苯甲腈(619-72-7)红外图谱(IR2) 对硝基苯甲腈(619-72-7)红外图谱(IR1) 对硝基苯甲腈(619-72-7)核磁图( 1 HNMR)