2,3-Dimethylanthraquinone

HCID 81019
NotesReactions
Substructure searchFind similar structures

Basic information

CAS
6531-35-7
Standard SMILES
Cc1cc2c(cc1C)C(=O)c1ccccc1C2=O
InChIKey
KIJPZYXCIHZVGP-UHFFFAOYSA-N
Molecular formula
C16H12O2
Average molar mass
236.26 g/mol
Monoisotopic mass
236.08372962

Names & identifiers

Preferred name
2,3-Dimethylanthraquinone
IUPAC
2,3-dimethylanthracene-9,10-dione
English name
2,3-Dimethylanthraquinone
Molecular formula
C16H12O2
Molecular weight
236.27

Names & synonyms

2,3-Dimethylanthraquinone6531-35-79,10-Anthracenedione, 2,3-dimethyl-DTXSID20215654RefChem:1059470DTXCID50138145624-209-72,3-dimethylanthracene-9,10-dioneMFCD000453792,3-Dimethylanthra-9,10-quinone2,3-DIMETHYL-9,10-DIHYDROANTHRACENE-9,10-DIONE2,3-dimethyl-anthraquinone
Show more names
DIMETHYLANTHRAQUINONE,2,3-2,3-Dimethylanthraquinone>2,3-Dimethylanthraquinone 98%DIMETHYLANTHRAQUINONE,2,3-(RG)2,3-Dimethylanthraquinone ,98%2,3-Dimethyl-9,10-anthraquinone
NSC 76612AKOS015842422AS-58492D2980T711822,3-Dimethyl-9,10-anthracenedione9, 2,3-dimethyl-FT-0636174

Database identifiers

CAS
6531-35-7
PubChem CID
81019
DTXSID
DTXSID20215654
EC Number
624-209-7
Nikkaji
J133.061F

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
34.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
0
Heavy atoms
18

Experimental & physicochemical properties

SpringerMaterials Properties13C nuclear magnetic resonance spectrum

Physicochemical properties

Melting point
210 · 210-212 °C (lit.)
Boiling point
338.73 °C · 338.73°C (rough estimate)
Density
1.1223 · 1.1223 (rough estimate)
refractive index
1.6 · 1.6000 (estimate)
form
powder to crystal
color
Light orange to Yellow to Green

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

PPE
dust mask type N95 (US), Eyeshields, Gloves
wgk
3
hs_code
2914.69.9000
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07

Chemistry & industry

Applications · 2 items

Uses2,3-Dimethylanthraquinone may be used as starting reagent in the regioselective synthesis of 6-amino-2,3-anthracenedimethanol.

General Description2,3-Dimethylanthraquinone is 2,3-dimethyl substituted anthraquinone and its synthesis has been reported. Electron transfer rate constants for the reaction between radical anions of 2,3-dimethylanthraquinone with benzyl bromide has been evaluated. The photoreactivity of 2,3-dimethylanthraquinone has been evaluated to investigate its usefulness as a photo-reagent for the analysis of ginsenosides using photoreduction fluorescence (PRF) detection method.

Upstream & downstream products

Suppliers64 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
成都彼样生物科技有限公司18108052721 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
武汉众志诚生物技术有限公司13628624121 13628604890 · [email protected]

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…