1,5-BIS(O-CARBOXYPHENYLTHIO)ANTHRAQUINONE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C28H16O6S2
Molecular Weight	512.553
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1,5-BIS(O-CARBOXYPHENYLTHIO)ANTHRAQUINONE

Structure Search

SMILES

OC(=O)C1=CC=CC=C1SC2=CC=CC3=C2C(=O)C4=C(C3=O)C(SC5=CC=CC=C5C(O)=O)=CC=C4

InChI

InChIKey=BCAONPSJOUWZBK-UHFFFAOYSA-N

InChI=1S/C28H16O6S2/c29-25-18-10-6-14-22(36-20-12-4-2-8-16(20)28(33)34)24(18)26(30)17-9-5-13-21(23(17)25)35-19-11-3-1-7-15(19)27(31)32/h1-14H,(H,31,32)(H,33,34)

HIDE SMILES / InChI

Molecular Formula	C28H16O6S2
Molecular Weight	512.553
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 18:51:36 GMT 2025` Edited by `admin` on `Mon Mar 31 18:51:36 GMT 2025`
Record UNII	I478TU90OL
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BENZOIC ACID, 2,2'-((9,10-DIHYDRO-9,10-DIOXO-1,5-ANTHRACENEDIYL)BIS(THIO))BIS-

Preferred Name

English

1,5-BIS(O-CARBOXYPHENYLTHIO)ANTHRAQUINONE

Common Name

English

1,5-BIS(2-CARBOXYPHENYLTHIO)ANTHRAQUINONE

Systematic Name

English

1,5-BIS(CARBOXYPHENYLTHIO)ANTHRAQUINONE

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

278-436-8