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3-METHYL-4-NITROBENZAMIDE

3-METHYL-4-NITROBENZAMIDE structure

CAS No:
99584-85-7
Formula:
C8H8N2O3
Chemical Name:
3-METHYL-4-NITROBENZAMIDE
Synonyms:
4-Nitro-m-toluamide;3-METHYL-4-NITROBENZAMIDE, 97%%;3-METHYL-4-NITROBENZAMIDE;Benzamide, 3-methyl-4-nitro-

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3-METHYL-4-NITROBENZAMIDE Basic Attributes

Molecular Weight：

180.16

Exact Mass：

180.05349212 g/mol

EC Number：

635-587-8

DSSTox ID：

DTXSID40344314

HScode：

2924299090

Characteristics

PSA：

88.91000

XLogP3：

2.22560

Density：

1.322

Melting Point：

158-160°C

Boiling Point：

321℃

Flash Point：

147.6ºC

Refractive Index：

1.599

Water Solubility：

Soluble in alcohol, slightly soluble in hot water.

PKA：

15.14±0.50

Safety Information

hazard class code：

36/37/38

safety instructions：

26-36/37/39

GHS Classification：

|Warning|H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]|P264, P280, P305+P351+P338, and P337+P313|Aggregated GHS information provided by 42 companies from 2 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:180.16
XLogP3:1.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:180.05349212
Monoisotopic Mass:180.05349212
Topological Polar Surface Area:88.9
Heavy Atom Count:13
Complexity:224
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-METHYL-4-NITROBENZAMIDE

Basic Attributes
Characteristics
Safety Information
Computed Properties

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