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3-nitro-N-(4-phenoxyphenyl)-benzamide

3-nitro-N-(4-phenoxyphenyl)-benzamide structure

CAS No:
316146-57-3
Formula:
C19H14N2O4
Chemical Name:
3-nitro-N-(4-phenoxyphenyl)-benzamide
Synonyms:
3-nitro-N-(4-phenoxyphenyl)-benzamide;ICA-105574;Benzamide, 3-nitro-N-(4-phenoxyphenyl)-

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3-nitro-N-(4-phenoxyphenyl)-benzamide Basic Attributes

Molecular Weight：

334.33

Exact Mass：

334.09535693 g/mol

DSSTox ID：

DTXSID80351981

Characteristics

PSA：

84.15000

XLogP3：

5.23560

Density：

1.333±0.06 g/cm3

Boiling Point：

430.9±30.0 °C(Predicted)

PKA：

11.76±0.70

Safety Information

Transport codes：

UN 3077 9 / PGIII

hazard class code：

36-43-50/53

safety instructions：

26-36/37-60-61

Marks：

Xi,N

GHS Classification：

|Warning|H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]|P261, P264, P272, P273, P280, P302+P352, P305+P351+P338, P321, P333+P313, P337+P313, P363, P391, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

3-nitro-N-(4-phenoxyphenyl)benzamide

Computed Properties

Molecular Weight:334.3
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:334.09535693
Monoisotopic Mass:334.09535693
Topological Polar Surface Area:84.2
Heavy Atom Count:25
Complexity:451
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-nitro-N-(4-phenoxyphenyl)-benzamide

Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties

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