Disperse Violet 1

HCID 31420

Basic information

CAS
128-95-0
Standard SMILES
Nc1ccc(N)c2c1C(=O)c1ccccc1C2=O
InChIKey
FBMQNRKSAWNXBT-UHFFFAOYSA-N
Molecular formula
C14H10N2O2
Average molar mass
238.24 g/mol
Monoisotopic mass
238.07422757

Names & identifiers

Preferred name
Disperse Violet 1
IUPAC
1,4-diaminoanthracene-9,10-dione
English name
1,4-Diamino anthraquinone
Molecular formula
C14H10N2O2
Molecular weight
238.24

Names & synonyms

1,4-Diaminoanthraquinone128-95-0Disperse violet 1KrisolamineAcetate Red Violet ROracet Violet 2RCibacet Violet 2R9,10-Anthracenedione, 1,4-diamino-Grasol Violet RSeacyl Violet RSetacyl Violet RDisperse Violet K
Show more names
1,4-diaminoanthracene-9,10-dioneCI 611001,4-diamino-9,10-anthracenedioneNSC 7833NSC 63807oilvioletrViolet ER
C.I. Disperse Violet 1Gracet Violet 2RResiren Violet TRSetile Violet 3RAmacel heliotrope RDuranol Violet 2RNacelan Violet 4RDispersive Violet K

Database identifiers

CAS
128-95-0、71775-54-7
PubChem CID
31420
DTXSID
DTXSID2041252
ChEMBL
CHEMBL86771
UNII
N21HDQ0TKN
EC Number
204-922-6、615-398-7
Nikkaji
J3.264F、J710.752H

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
86.2 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
0
Heavy atoms
18

Physicochemical properties

Melting point
265 · 265-269 °C(lit.)
Boiling point
380.84 °C · 380.84°C (rough estimate)
Density
1.44 g/cm3 · 1.44 g/cm3 (20℃)
vapor pressure
1 hPa · <1 hPa (25 °C)
refractive index
1.65 · 1.6500 (estimate)
Flash point
340 °C · 340 °C

Safety & regulation

Safety data

PPE
Eyeshields, Gloves, type N95 (US)
wgk
2
tsca
TSCA listed
rtecs
CB6300000
hs_code
29223990
Toxicity
LD50 orally in Rabbit: 5790 mg/kg

Chemistry & industry

Applications · 2 items

UsesAs an anthraquinone derivative, 1,4-Diamino anthraquinone is a potent and selective protein kinase CK1 delta inhibitor. Studies suggest that it has potential solar cell applications. 1,4-Diamino anthraquinone can be used in studies as a potential competitive non-peptidic inhibitor of HIV-1 proteinase.

UsesUse as the intermediate of synthetic dyes. Use anthraquinone reductive dyes and dispersal dyes and acid dyes and intermediates. Itself to disperse dyestuffs purple. 1,4-Diaminoanthraquinone oxidized with different metal atoms gives rise to conducting coordination polymers consisting of difunctional ligand molecules linked by metal atoms. 1, 4-diaminoanthraquinone has solar cell applications. A hybrid Si/poly (1, 4-diaminoanthraquinone) photoconductive diode for optical sensor applications. Acts as the sequential incorporation of the mediator in electrochemical sensing of glucose on a gold electrode.

Suppliers100 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
南通润丰石油化工有限公司66017690 19952660367 · [email protected]

Related reactions

18 records

Compound notes

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