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3-methyl-4-nitrobenzaldehyde

3-methyl-4-nitrobenzaldehyde structure

CAS No:
18515-67-8
Formula:
C8H7NO3
Chemical Name:
3-methyl-4-nitrobenzaldehyde
Synonyms:
3-Methyl-4-nitrobenzaldehyd; 4-Nitro-m-toluylaldehyd; 4-Formyl-2-methylnitrobenzene; 5-Formyl-2-nitrotoluene; Benzaldehyde,3-methyl-4-nitro; 3-methyl-4-nitro-benzaldehyde;Expand
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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3-methyl-4-nitrobenzaldehyde Basic Attributes

Molecular Weight：

165.14600

Exact Mass：

165.042593085

DSSTox ID：

DTXSID80458267

Characteristics

PSA：

62.89000

XLogP3：

2.23890

Density：

1.278g/cm3

Boiling Point：

304.4ºC at 760mmHg

Flash Point：

151.2ºC

Refractive Index：

1.602

Vapor Pressure：

0.000877mmHg at 25°C

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:165.15
XLogP3:2.3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:165.042593085
Monoisotopic Mass:165.042593085
Topological Polar Surface Area:62.9
Heavy Atom Count:12
Complexity:187
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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3-Methyl-4-nitrobenzaldehyde

CAS No.: 18515-67-8

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Guide of 3-methyl-4-nitrobenzaldehyde

Basic Attributes
Characteristics
Safety Information
Computed Properties
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