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4,6-BIS(BENZOYLAMINO)-1,3-BENZENEDICARBOXYLICACID

4,6-BIS(BENZOYLAMINO)-1,3-BENZENEDICARBOXYLICACID structure

CAS No:
70553-45-6
Formula:
C22H16N2O6
Chemical Name:
4,6-BIS(BENZOYLAMINO)-1,3-BENZENEDICARBOXYLICACID
Synonyms:
5-carboxyl-2,4-di-benzamidobenzoic acid;NS3763;NS 3763;4,6-dibenzamidobenzene-1,3-dicarboxylic acid;4,6-Bis(benzamido)isophthalic acid;5-Carboxy-2,4-dibenzamidobenzoic acid;NS-3763;CHEMBL156717;4,6-bis(benzoylamino)-1,3-benzenedicarboxylic acid

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4,6-BIS(BENZOYLAMINO)-1,3-BENZENEDICARBOXYLICACID Basic Attributes

Molecular Weight：

404.37

Exact Mass：

404.10100

DSSTox ID：

DTXSID00402343

Characteristics

PSA：

132.80000

XLogP3：

3.73360

Appearance：

off-white solid

Density：

1.485g/cm3

Boiling Point：

490.7ºC at 760 mmHg

Flash Point：

250.6ºC

Refractive Index：

1.735

Water Solubility：

DMSO: ~24 mg/mL

Storage Conditions：

2-8°C

Safety Information

Transport codes：

UN 3077 9/PG 3

wgk germany：

hazard class code：

36/37/38-50/53

safety instructions：

26-36-60-61

Marks：

Xi,N

Precautionary statement(s)：

P261-P273-P305 + P351 + P338-P501

Hazard Statements：

H315-H319-H335-H410

GHS Classification：

|Warning|H315 (100%): 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, P391, P403+P233, P405, 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：

5-carboxyl-2,4-di-benzamidobenzoic acid

Computed Properties

Molecular Weight:404.4
XLogP3:3.7
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:404.10083623
Monoisotopic Mass:404.10083623
Topological Polar Surface Area:133
Heavy Atom Count:30
Complexity:600
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4,6-BIS(BENZOYLAMINO)-1,3-BENZENEDICARBOXYLICACID

Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties

4,6-BIS(BENZOYLAMINO)-1,3-BENZENEDICARBOXYLICACID

SDS

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