CAS 131-14-6 9,10-Anthracenedione, 2,6-diamino- (HCID 8557)

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Basic information

CAS: 131-14-6
Standard SMILES: Nc1ccc2c(c1)C(=O)c1ccc(N)cc1C2=O
InChIKey: WQOWBWVMZPPPGX-UHFFFAOYSA-N
Molecular formula: C14H10N2O2
Average molar mass: 238.246 g/mol
Monoisotopic mass: 238.07422756

Names & identifiers

Preferred name: 9,10-Anthracenedione, 2,6-diamino-
IUPAC: 2,6-Diaminoanthracene-9,10-dione
English name: 2,6-Diaminoanthraquinone
Molecular formula: C14H10N2O2
Molecular weight: 238.24

Names & synonyms

2,6-diaminoanthracene-9,10-dione2,6-DAAQ2,6-Diaminoanthracene2,6-diamino-9,10-anthraquinone2,6-diaminoanthra-9,10-quinoneNSC-399356-DiaMinoanthraquinone2,6-diaminoanthrachinon2,6-diamino-anthraquinon2,6-DIAMINOANTHRAQUINONE

Database identifiers

CAS: 131-14-6
PubChem CID: 8557
DTXSID: DTXSID5059614
ChEMBL: CHEMBL90729
UNII: 3DY0EUZ2ZM
EC Number: 205-013-7
Nikkaji: J2.943B

Properties

Physicochemical properties

Melting point: 325 °C · >325 °C (lit.)
Boiling point: 380.84 °C · 380.84°C (rough estimate)
Density: 1.1907 · 1.1907 (rough estimate)
refractive index: 1.65 · 1.6500 (estimate)
storage temp.: Keep in dark place,Inert atmosphere,Room temperature
solubility: insoluble in Chloroform
form: powder to crystal
pka: 1.32 · 1.32±0.20(Predicted)
color: Reddish-brown
Stability: Stable. Incompatible with strong oxidizing agents.
InChI: InChI=1S/C14H10N2O2/c15-7-1-3-9-11(5-7)14(18)10-4-2-8(16)6-12(10)13(9)17/h1-6H,15-16H2
InChIKey: WQOWBWVMZPPPGX-UHFFFAOYSA-N
SMILES: C1=C2C(C(=O)C3=C(C2=O)C=CC(N)=C3)=CC=C1N
CAS DataBase Reference: 131 · 131-14-6(CAS DataBase Reference)
FDA UNII: 3 DY0EUZ2ZM · 3DY0EUZ2ZM
EPA Substance Registry System: 9 · 9,10-Anthracenedione, 2,6-diamino- (131-14-6)
UNSPSC Code: 12352100 · 12352100
NACRES: 22 · NA.22
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
target organs: Respiratory system
Hazard Codes: Xi
Risk Statements: 36 · 36/37/38
Safety Statements: 26 · 26-36
WGK Germany: 3 · 3
RTECS: 6450000 · CB6450000
TSCA: TSCA listed
HS Code: 29223990 · 29223990
Storage Class: 11 · 11 - Combustible Solids
Hazard Classifications: 2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3
Toxicity: 500 mg/24H · eye-rbt 500 mg/24H MLD 28ZPAK -,122,72

Safety & regulation

Safety data

wgk: 3
tsca: TSCA listed
rtecs: CB6450000
hs_code: 29223990
Toxicity: eye-rbt 500 mg/24H MLD 28ZPAK -,122,72
risk_code: 36/37/38
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
safety_code: 26-36
Storage Class: 11 - Combustible Solids
target organs: Respiratory system
Hazard statements: H315-H319-H335
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
Precautionary statements: P261-P264-P271-P280-P302+P352-P305+P351+P338

Chemistry & industry

Applications

Uses2,6-Diaminoanthraquinone is a dye intermediate used to manufacture vat dyes such as Vat Yellow GCN (Vat Yellow GCN).

Upstream & downstream products

Upstream raw materials

Downstream products

Vat Yellow 2 2,7-diaminoanthracene-9,10-dione 2,6-Dibromoanthraquinone

Suppliers100 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

郑州阿尔法化工有限公司+86-18530059196 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]

湖南韵邦生物科技股份有限公司85561037 15386497078 · [email protected]

Related reactions

1 records

New reaction record

HRID 1391353As reactantuspto-grants-1979_02

Compound notes

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