Solvent Blue 68

HCID 20419
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Basic information

CAS
4395-65-7
Standard SMILES
Nc1ccc(Nc2ccccc2)c2c1C(=O)c1ccccc1C2=O
InChIKey
XUDJOVURIXHNRW-UHFFFAOYSA-N
Molecular formula
C20H14N2O2
Average molar mass
314.3 g/mol
Monoisotopic mass
314.10552769

Names & identifiers

Preferred name
Solvent Blue 68
IUPAC
1-amino-4-anilinoanthracene-9,10-dione
English name
1-Amino-4-anilinoanthraquinone
Molecular formula
C20H14N2O2
Molecular weight
314.34

Names & synonyms

4395-65-7Solvent Blue 68C.I. Solvent Blue 689,10-Anthracenedione, 1-amino-4-(phenylamino)-Disperse Blue 191-AMINO-4-ANILINOANTHRAQUINONE7HI7UVD4XG1-Amino-4-(phenylamino)anthraquinoneC.I. DISPERSE BLUE 19Anthraquinone, 1-amino-4-anilino-EINECS 224-520-4CI SOLVENT BLUE 68
Show more names
solventblue68ORACET BLUE 2RTerasil Blue 2RC.I.DISPERSEBLUE19C.I.Solvent Blue 68Solvent blue 68 (C.I. 61110)C.I.Solvent Blue 68:C.I.61110C.I.Disperse Blue 19:C.I.61110
CI DISPERSE BLUE 191-amino-4-(phenylamino)-9,10-dihydroanthracene-9,10-dioneDTXSID9041738CI 61110C.I. 611101-AMINO-4-P-ANILINO-9,10-ANTHRAQUINONERefChem:888118DTXCID7021738

Database identifiers

CAS
4395-65-7
PubChem CID
20419
DTXSID
DTXSID9041738
UNII
7HI7UVD4XG
EC Number
224-520-4
Nikkaji
J58.322G

Properties

Computed structural properties

XLogP
4.8
Topological polar surface area
72.2 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
24

Experimental & physicochemical properties

SpringerMaterials PropertiesBoiling point

Physicochemical properties

Melting point
194 °C · 194°C
Boiling point
454.02 °C · 454.02°C (rough estimate)
Density
1.2303 · 1.2303 (rough estimate)
refractive index
1.57 · 1.5700 (estimate)
pka
0.46 · 0.46±0.20(Predicted)
form
Solid

Safety & regulation

GHS classification

GHS Classification · 4 items

This chemical does not meet GHS hazard criteria for 23.1% (28 of 121) of reports.

H413 (75.2%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]

P273, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 121 reports by companies from 4 notifications to the ECHA C&L Inventory.

Hazard information

Regulatory Information · 3 items

Chemical: 9,10-Anthracenedione, 1-amino-4-(phenylamino)-

Hazard Traits - Bioaccumulation; Environmental Persistence

9,10-Anthracenedione, 1-amino-4-(phenylamino)-: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationIMAP assessments - 9,10-Anthracenedione, 1-amino-4-(phenylamino)-: Environment tier I assessment
Hazard Classes and CategoriesAquatic Chronic 4 (75.2%)

Safety data

tsca
TSCA listed
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H413-H317
Autoignition Temperature
590°C
Precautionary statements
P261-P272-P280-P302+P352-P333+P313-P321-P363-P501

Chemistry & industry

Uses & manufacturing

General Manufacturing Information9,10-Anthracenedione, 1-amino-4-(phenylamino)-: ACTIVE

Preparation methods

Preparation1-Amino-4-hydroxyanthfacene-9,10-dionewith aniline in the presence of boric acid in condensation.

Upstream & downstream products

Upstream raw materials

Suppliers24 total

合肥翰刚医药科技有限公司+8618062405514 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
湖北云镁科技有限公司027-59206672 18995657604 · [email protected]
湖北佩孜医药科技有限公司0712-4220300 17720472265 · [email protected]
湖北威德利化学试剂有限公司17771473825 13385289472 · [email protected]

Related reactions

2 records
New reaction record

Compound notes

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