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1-Methyl 2-nitro-1,4-benzenedicarboxylate

1-Methyl 2-nitro-1,4-benzenedicarboxylate structure

CAS No:
35092-89-8
Formula:
C9H7NO6
Chemical Name:
1-Methyl 2-nitro-1,4-benzenedicarboxylate
Synonyms:
1,4-Benzenedicarboxylic acid,2-nitro-,1-methyl ester;1-Methyl 2-nitro-1,4-benzenedicarboxylate;4-Methoxycarbonyl-3-nitrobenzoic acid;NSC 151109;2-Nitroterephthalic acid 1-methyl ester;1-Methyl 2-nitroterephthalate;Methyl 4-carboxy-2-nitrobenzoate;1-Nitrobenzene-2-methyloxycarbonyl-5-carboxylic acid
Categories:
Chemical Reagents > Organic Reagents

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1-Methyl 2-nitro-1,4-benzenedicarboxylate Basic Attributes

Molecular Weight：

225.15

Exact Mass：

225.15

EC Number：

252-360-5

NSC Number：

151109

HScode：

2918990090

Characteristics

PSA：

109

XLogP3：

1.60280

Density：

1.484 g/cm3

Melting Point：

177-179 °C @ Solvent: Water

Boiling Point：

393.4ºC at 760 mmHg

Flash Point：

191.7ºC

Refractive Index：

1.594

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-36

Marks：

Hazard note：

Irritant

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

GHS Classification：

|Warning|H315 (55.13%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 78 companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:225.15
XLogP3:1.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:225.02733694
Monoisotopic Mass:225.02733694
Topological Polar Surface Area:109
Heavy Atom Count:16
Complexity:310
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 35092-89-8

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Guide of 1-Methyl 2-nitro-1,4-benzenedicarboxylate

Basic Attributes
Characteristics
Safety Information
Computed Properties
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Latest News
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1-Methyl 2-nitro-1,4-benzenedicarboxylate

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