Basic information
- CAS
20241-75-2- Standard SMILES
Cc1ccc(Nc2ccc(O)c3c2C(=O)c2c(O)ccc(Nc4ccc(C)cc4)c2C3=O)cc1- InChIKey
USXUIUWGIGFKRR-UHFFFAOYSA-N- Molecular formula
- C28H22N2O4
- Average molar mass
- 450.5 g/mol
- Monoisotopic mass
- 450.15795719
Names & identifiers
- Preferred name
- Toluidine Blue Base
- IUPAC
- 1,5-dihydroxy-4,8-bis(4-methylanilino)anthracene-9,10-dione
- English name
- 1,5-dihydroxy-4,8-bis[(4-methylphenyl)amino]anthraquinone
- Molecular formula
- C28H22N2O4
- Molecular weight
- 450.49
Names & synonyms
Toluidine Blue Base20241-75-2M5E2LAL0WJ9,10-Anthracenedione, 1,5-dihydroxy-4,8-bis[(4-methylphenyl)amino]-EINECS 243-631-9UNII-M5E2LAL0WJNSC 227205NSC-227205NSC-5088981,5-Dihydroxy-4,8-p-toluidinoanthraquinoneDTXSID60665779,10-Anthracenedione, 1,5-dihydroxy-4,8-bis((4-methylphenyl)amino)-
Show more names
1,5-dihydroxy-4,8-bis(p-tolylamino)anthracene-9,10-dione1,5-dihydroxy-4,8-bis[(4-methylphenyl)amino]anthraquinone
1,5-BIS(4-TOLUIDINO)-4,8-DIHYDROXYANTHRAQUINONEANTHRAQUINONE, 1,5-DIHYDROXY-4,8-DI-P-TOLUIDINO-1,5-BIS(4-METHYLANILINO)-4,8-DIHYDROXYANTHRAQUINONE1,5-Dihydroxy-4,8-bis[(4-methylphenyl)amino]-9,10-anthracenedione1,5-DIHYDROXY-4,8-BIS((4-METHYLPHENYL)AMINO)-9,10-ANTHRACENEDIONERefChem:190314DTXCID3036232243-631-9
Database identifiers
- CAS
20241-75-2- PubChem CID
- 72741
- DTXSID
DTXSID6066577- UNII
- M5E2LAL0WJ
- EC Number
- 243-631-9
Properties
Computed structural properties
- XLogP
- 7.1
- Topological polar surface area
- 98.7 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 681
Physicochemical properties
- FDA UNII
- 5 E2LAL0WJ · M5E2LAL0WJ
- EPA Substance Registry System
- 9 · 9,10-Anthracenedione, 1,5-dihydroxy-4,8-bis[(4-methylphenyl)amino]- (20241-75-2)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information9,10-Anthracenedione, 1,5-dihydroxy-4,8-bis[(4-methylphenyl)amino]-: ACTIVE
Suppliers1 total
南京材化电子新材料有限公司01586919 18901586919 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…