产品名称

英文名称：4-Chloro-3-nitrobenzonitrile

同义词

SR-01000510901-1 、 SCHEMBL6463 、 AM20041434 、 BDBM50101954 、 AKOS000427999 、 FT-0618085 、 DTXSID50239868 、 EINECS 213-364-2 、 SCHEMBL17347334 、 CS-D1140 、 EN300-18076 、 BRN 1639111 、 EU-0050984 、 Z57151919 、 4-Chloro-3-nitrobenzonitrile, 97% 、 MFCD0001698、4-氯-3-硝基苯腈

产品性质

CAS编号：939-80-0

分子式：ClC6H3(NO2)CN

分子量：182.56

Beilstein号：1639111

EC号：213-364-2

MDL号：MFCD00016987

PubChem编号：13655

别名：4-氯-3-硝基苯腈

英文别名：SR-01000510901-1 | SCHEMBL6463 | AM20041434 | BDBM50101954 | AKOS000427999 | FT-0618085 | DTXSID50239868 | EINECS 213-364-2 | SCHEMBL17347334 | CS-D1140 | EN300-18076 | BRN 1639111 | EU-0050984 | Z57151919 | 4-Chloro-3-nitrobenzonitrile, 97% | MFCD0001698

规格或纯度：98%

英文名称：4-Chloro-3-nitrobenzonitrile

运输条件：常规运输

产品介绍：application4-Chloro-3-nitrobenzonitrile may be used in the synthesis of 3-nitro-4-thiocyanobenzonitryl.4-Chloro-3-nitrobenzonitrile may be employed for the radiosynthesis of analogs of serotonin transporter (SERT) ligands for use in positron emission tomography (PET) studies and for the preparation of N-(4-cyano-2-nitrophenyl)glycine.product descriptionFT-IR and μ-Raman spectra of 4-chloro-3-nitrobenzonitrile have been recorded in the range of 400-4000cm-1 and 100-4000cm-1, respectively. It has been prepred from the reaction of 4-chloro-3-nitrobenzamide and phosphorus oxychloride. Crystal structure of 4-chloro-3-nitrobenzonitrile has been reported. Molecules of 4-chloro-3-nitrobenzonitrile are linked by weak intermolecular C-H…O and C-H…N hydrogen bonds.

PubChem SID：488181884

IUPAC Name：4-chloro-3-nitrobenzonitrile

INCHI：InChI=1S/C7H3ClN2O2/c8-6-2-1-5(4-9)3-7(6)10(11)12/h1-3H

InChi Key：XBLPHYSLHRGMNW-UHFFFAOYSA-N

Canonical SMILES：C1=CC(=C(C=C1C#N)[N+](=O)[O-])Cl

Isomeric SMILES：C1=CC(=C(C=C1C#N)[N+](=O)[O-])Cl

WGK Germany：2

RTECS：DI3050000

PubChem CID：13655

Reaxy-Rn：1639111

溶解性：微溶于水

熔点：98-102°C

象形图：

信号词：Warning

危险声明：H315 Causes skin irritationH319 Causes serious eye irritationH335 May cause respiratory irritation

预防措施声明：P261,P305+P351+P338,P280,P302+P352,P321,P405,P501,P264,P271,P304+P340,P403+P233,P362+P364,P264+P265,P337+P317,P332+P317,P319

个人防护装备：dust mask type N95 (US), Eyeshields, Gloves

产品包装