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Benzoic acid, 2-chloro-4-nitro-, methyl ester

Benzoic acid, 2-chloro-4-nitro-, methyl ester structure

CAS No:
13324-11-3
Formula:
C8H6ClNO4
Chemical Name:
Benzoic acid, 2-chloro-4-nitro-, methyl ester
Synonyms:
Benzoic acid,2-chloro-4-nitro-,methyl ester;Methyl 2-chloro-4-nitrobenzoate;2-Chloro-4-nitrobenzoic acid methyl ester;4-nitro-2-chlorobenzoic acid methyl ester
Categories:
Inorganic Chemistry > Elementary Substance

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Benzoic acid, 2-chloro-4-nitro-, methyl ester Basic Attributes

Molecular Weight：

215.59100

Exact Mass：

215.59

EC Number：

236-362-3

DSSTox ID：

DTXSID30158023

HScode：

2916399090

Characteristics

PSA：

72.12000

XLogP3：

2.55800

Appearance：

almost beige powder

Density：

1.426g/cm3

Melting Point：

75.5-76.7 °C

Boiling Point：

324.8ºC

Flash Point：

150.2ºC

Refractive Index：

1.568

Vapor Pressure：

0.00024mmHg at 25°C

Safety Information

hazard class code：

R36/37/38

safety instructions：

S26-S37/39

Marks：

GHS Classification：

|Warning|H302 (86.36%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 44 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:215.59
XLogP3:2.4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:214.9985354
Monoisotopic Mass:214.9985354
Topological Polar Surface Area:72.1
Heavy Atom Count:14
Complexity:240
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Benzoic acid, 2-chloro-4-nitro-, methyl ester

Basic Attributes
Characteristics
Safety Information
Computed Properties
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