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1,3-Benzenediol, 2,4-bis[(dimethylphenyl)azo]-

HCID 79974
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Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
29190-28-1
Standard SMILES
Cc1ccc(NN=c2ccc(=O)c(=NNc3ccc(C)cc3C)c2=O)c(C)c1
InChIKey
JTHUBMQPODORFF-UHFFFAOYSA-N
Molecular formula
C22H22N4O2
Average molar mass
374.4 g/mol
Monoisotopic mass
374.17427596

Overview

See also: Resorcinol, 2,4-bis(xylylazo)- (annotation moved to) ... View More ...

Names & identifiers

Preferred name
1,3-Benzenediol, 2,4-bis[(dimethylphenyl)azo]-
IUPAC
2,6-bis[(2,4-dimethylphenyl)hydrazinylidene]cyclohex-4-ene-1,3-dione

Names & synonyms

1,3-Benzenediol, 2,4-bis[(dimethylphenyl)azo]-29190-28-1SCHEMBL19958473WMIICSQDNIXFKP-UHFFFAOYSA-NNS00020432

Database identifiers

CAS
29190-28-1
PubChem CID
79974
EC Number
249-495-7

Properties

Computed structural properties

XLogP
5.1
Topological polar surface area
82.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
4
Heavy atoms
28
Formal charge
0
Complexity
697

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 5 items

This chemical does not meet GHS hazard criteria for 81.1% (257 of 317) of all reports.

Warning

H319 (18.9%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)

Aggregated GHS information provided per 317 reports by companies from 2 notifications to the ECHA C&L Inventory.

Hazard information

Regulatory Information1,3-Benzenediol, 2,4-bis[(dimethylphenyl)azo]-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and CategoriesEye Irrit. 2 (18.9%)

Chemistry & industry

Uses & manufacturing

General Manufacturing Information1,3-Benzenediol, 2,4-bis[2-(dimethylphenyl)diazenyl]-: ACTIVE

Related reactions

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes