1-(Methylamino)-4-((4-methylphenyl)amino)anthraquinone

HCID 67195
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Substructure searchFind similar structures

Basic information

CAS
128-85-8
Standard SMILES
CNc1ccc(Nc2ccc(C)cc2)c2c1C(=O)c1ccccc1C2=O
InChIKey
ITYXXSSJBOAGAR-UHFFFAOYSA-N
Molecular formula
C22H18N2O2
Average molar mass
342.4 g/mol
Monoisotopic mass
342.13682782

Names & identifiers

Preferred name
1-(Methylamino)-4-((4-methylphenyl)amino)anthraquinone
IUPAC
1-(methylamino)-4-(4-methylanilino)anthracene-9,10-dione
English name
SUDAN BLUE
Molecular formula
C22H18N2O2
Molecular weight
342.39

Names & synonyms

9,10-Anthracenedione, 1-(methylamino)-4-[(4-methylphenyl)amino]-9,10-Anthracenedione, 1-(methylamino)-4-((4-methylphenyl)amino)-DTXSID50595831-(Methylamino)-4-((4-methylphenyl)amino)anthraquinone1-(methylamino)-4-[(4-methylphenyl)amino]anthraquinoneRefChem:427985DTXCID1033907204-912-1128-85-8Solvent Blue 111-(Methylamino)-4-p-toluidinoanthraquinoneSudan Blue GA
Show more names
NSC39906NSC 39906NSC-39906Solvent Blue PC.I.SOLVENTBLUE11Sudan Blue/Solvent Blue 11Solvent blue 11 (C.I. 61525)C.I.Solvent Blue 11:C.I.61525Oil Blue G Extra Solvent Blue 11
Organol Blue JSomalia Blue GWaxoline Blue GAC.I. Solvent Blue 11SudanblueNitro Fast Blue 3GBSuperlan Astrol B BaseOrganol Brilliant Blue J

Database identifiers

CAS
128-85-8
PubChem CID
67195
DTXSID
DTXSID5059583
EC Number
204-912-1
Nikkaji
J5.415A

Properties

Computed structural properties

XLogP
5.9
Topological polar surface area
58.2 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
26

Physicochemical properties

Boiling point
575.1 · 575.1±50.0 °C(Predicted)
Density
1.312 · 1.312±0.06 g/cm3(Predicted)
Colour Index
61525 · 61525
pka
4.29 · 4.29±0.20(Predicted)
EPA Substance Registry System
9 · 9,10-Anthracenedione, 1-(methylamino)-4-[(4-methylphenyl)amino]- (128-85-8)
TSCA
TSCA listed

Safety & regulation

GHS classification

GHS Classification · 3 items

This chemical does not meet GHS hazard criteria for 100% (16 of 16) of all reports.

Not Classified

Aggregated GHS information provided per 16 reports by companies from 1 notifications to the ECHA C&L Inventory.

Hazard information

Regulatory InformationChemical: 9,10-Anthracenedione, 1-(methylamino)-4-[(4-methylphenyl)amino]-
Hazard Classes and CategoriesNot Classified

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing Information9,10-Anthracenedione, 1-(methylamino)-4-[(4-methylphenyl)amino]-: ACTIVE

Preparation methods

Preparation1-Bromo-4-(methylamino)anthracene-9,10-dione and p-Methylaniline reaction.

Upstream & downstream products

Upstream raw materials

Suppliers29 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
郑州鸿晟医药科技有限公司0371-55695890 15637198702 · [email protected]

Related reactions

2 records
New reaction record

Compound notes

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