1,8-Dichloroanthraquinone

HCID 6708CAS 82-43-9
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C1c2cccc(Cl)c2C(=O)c2c(Cl)cccc21
InChIKey
VBQNYYXVDQUKIU-UHFFFAOYSA-N
Molecular formula
C14H6Cl2O2
Average molar mass
277.1 g/mol
Monoisotopic mass
275.97448479

Names & identifiers

Preferred name
1,8-Dichloroanthraquinone
IUPAC
1,8-dichloroanthracene-9,10-dione
English name
1,8-Dichloroanthraquinone
Molecular formula
C14H6Cl2O2
Molecular weight
277.1

Names & synonyms

1,8-Dichloroanthraquinone9,10-Anthracenedione, 1,8-dichloro-EINECS 201-420-9BRN 1979205AI3-38302NSC 7209Anthraquinone, 1,8-dichloroDTXSID80588734-07-00-02560 (Beilstein Handbook Reference)1,8DichloranthrachinonRefChem:73741Anthraquinone, 1,8dichloro
Show more names
1,8-DichLoroanthraquinone1,8-dichloro-anthraquinon1,8-Dichloroanthraquinone,97%1,8-Dichloroanthraquinone,96%1,8-Dichloroanthraquinone >1,8-Dichloroanthra-9,10-quinone1,8-Dichloro-9,10-anthraquinone
1,8Dichloro9,10anthraquinoneDTXCID60482509,10Anthracenedione, 1,8dichloro201-420-9VBQNYYXVDQUKIU-UHFFFAOYSA-N82-43-91,8-dichloroanthracene-9,10-dione1,8-Dichloranthrachinon

Database identifiers

CAS
82-43-9
PubChem CID
6708
DTXSID
DTXSID8058873
UNII
HNW5L47GP6
EC Number
201-420-9
Nikkaji
J53.414E

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

Chemical ClassesDyes -> Anthraquinone Dyes
SpringerMaterials PropertiesCrystal structure
Physical DescriptionPowder; [Alfa Aesar MSDS]

Physicochemical properties

Melting point
201.5 · 201.5-203 °C (lit.)
Boiling point
387.84 °C · 387.84°C (rough estimate)
Density
1.324 · 1.3240 (rough estimate)
vapor pressure
0 · 0-0Pa at 25℃
refractive index
1.473 · 1.4730 (estimate)
storage temp.
Sealed in dry,Room Temperature

Safety & regulation

GHS classification

GHS Classification · 5 items

This chemical does not meet GHS hazard criteria for 27.3% (3 of 11) of reports.

Warning

H315 (18.2%): 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 11 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory InformationStatus: Active Update: 20-03-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/22982
Hazards SummaryA mild eye irritant; [RTECS] An eye irritant; [Alfa Aesar MSDS] See 1-Amino-5-chloroanthraquinone.
Hazard Classes and CategoriesSkin Irrit. 2 (18.2%)

Safety data

PPE
Eyeshields, Gloves, type N95 (US)
wgk
3
tsca
TSCA listed
rtecs
CB6496000
hs_code
2914790090
risk_code
36/37/38

Chemistry & industry

Uses & manufacturing

General Manufacturing Information9,10-Anthracenedione, 1,8-dichloro-: ACTIVE

Applications

Uses1,8-Dichloroanthraquinone is a reagent in the preparation of anthraquinones, which has antitumor activities. It is used as primary and secondary intermediate.

Upstream & downstream products

Suppliers50 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]
苏州启航生物科技有限公司18151111370 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]

Related reactions

16 records
New reaction record

Linked notes

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