Basic information
- CAS
128-81-4- Standard SMILES
Nc1c2c(=O)[nH]c(=O)c2c(N)c2c(=O)c3ccccc3c(=O)c12- InChIKey
UOBRDAVIVQKFCM-UHFFFAOYSA-N- Molecular formula
- C16H9N3O4
- Average molar mass
- 307.26 g/mol
- Monoisotopic mass
- 307.05930577
Names & identifiers
- Preferred name
- 1,4-Diamino-2,3-anthraquinonedicarboximide
- IUPAC
- 4,11-diaminonaphtho[2,3-f]isoindole-1,3,5,10-tetrone
- English name
- 4,11-diamino-1H-naphth[2,3-f]isoindole-1,3,5,10(2H)-tetrone
- Molecular formula
- C16H9N3O4
- Molecular weight
- 307.26
Names & synonyms
128-81-44,11-Diamino-1H-naphth[2,3-f]isoindole-1,3,5,10(2H)-tetrone1H-Naphth[2,3-f]isoindole-1,3,5,10(2H)-tetrone, 4,11-diamino-YG2LVB01V31,4-Diamino-2,3-anthraquinonedicarboximideEINECS 204-910-0NSC 115447NSC-115447DTXSID00595801H-Naphth(2,3-f)isoindole-1,3,5,10(2H)-tetrone, 4,11-diamino-1,4-Diamino-9,10-dihydro-9,10-dioxo-2,3-anthracenedicarboximide4,11-Diamino-1H-naphth(2,3-f)isoindole-1,3,5,10(2H)-tetrone
Show more names
4,7-Diamino-5,6-phthaloylisoindoline-1,3-dione4,11-Diamino-2H-naphth[2,3-f]isoindole-1,3,5,10-tetrone1H-Naphth[2,3-f]isoindole-1,3,5,10(2H)-tetrone,4,11-diaMino-4,11-diaMino-1h-naphtho[2,3-f]isoindole-1,3,5,10(2h)-tetrone-1,4-Diamino-9,10-dihydro-9,10-dioxoanthracene-2,3-dicarbimide
4,11-diamino-1H-naphtho[2,3-f]isoindole-1,3,5,10(2H)-tetraone2,3-Anthracenedicarboximide, 1,4-diamino-9,10-dihydro-9,10-dioxo-2,3-ANTHRAQUINONEDICARBOXIMIDE, 1,4-DIAMINO-4,11-DIAMINO-1H-NAPHTHO(2,3-F)ISOINDOLE-1,3,5,10(2H)-TETRAONERefChem:416650DTXCID60339042,3-Anthracenedicarboximide, 1,4-diamino-9,10-dihydro-9,10-dioxo-(8CI)204-910-0
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 132 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 566
Physicochemical properties
- Melting point
- 300 °C · >300 °C
- Density
- 1.69 · 1.690±0.06 g/cm3(Predicted)
- pka
- 8.27 · 8.27±0.20(Predicted)
- FDA UNII
- 2 LVB01V3 · YG2LVB01V3
- EPA Substance Registry System
- 1 H-Naphth[2,3-f]isoindole-1,3,5,10 · 1H-Naphth[2,3-f]isoindole-1,3,5,10(2H)-tetrone, 4,11-diamino- (128-81-4)
- TSCA
- TSCA listed
Safety & regulation
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1H-Naphth[2,3-f]isoindole-1,3,5,10(2H)-tetrone, 4,11-diamino-: ACTIVE
Applications
Uses1,4,-Diaminoanthraquinone-2,3-dicarboxyimide is the intermediate for CI Disperse Blue 60.
Suppliers5 total
Syntechem Co.,Ltd[email protected]
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
池州凯隆进出口贸易有限公司[email protected]
Shaanxi Dideu New Materials Co. Ltd18192503167 · [email protected]
SUZHOU SENFEIDA CHEMICAL CO.,LTD+86-0512-83500002 +86-15195660023 · [email protected]
Related reactions
3 records
Compound notes
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