7-Acetoxymethyl-12-methylbenz(a)anthracene

Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H18O2
Molecular Weight	314.3771
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 7-Acetoxymethyl-12-methylbenz(a)anthracene

Structure Search

SMILES

CC(=O)OCC1=C2C=CC3=CC=CC=C3C2=C(C)C4=CC=CC=C14

InChI

InChIKey=QZBZIXDRHVAJSX-UHFFFAOYSA-N

InChI=1S/C22H18O2/c1-14-17-8-5-6-10-19(17)21(13-24-15(2)23)20-12-11-16-7-3-4-9-18(16)22(14)20/h3-12H,13H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C22H18O2
Molecular Weight	314.3771
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 22:03:00 GMT 2025` Edited by `admin` on `Mon Mar 31 22:03:00 GMT 2025`
Record UNII	GU67JAC9XY
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

12-Methylbenz(a)anthracene-7-methanol acetate (ester)

Preferred Name

English

7-Acetoxymethyl-12-methylbenz(a)anthracene

Systematic Name

English

Benz(a)anthracene-7-methanol, 12-methyl-, acetate

Systematic Name

English

(12-methylbenzo[a]anthracen-7-yl)methyl acetate

Systematic Name

English

Benz[a]anthracene-7-methanol, 12-methyl-, 7-acetate

Systematic Name

English

Code System Code Type Description

FDA UNII

GU67JAC9XY

Created by admin on Mon Mar 31 22:03:01 GMT 2025 , Edited by admin on Mon Mar 31 22:03:01 GMT 2025

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CAS

2517-98-8

Created by admin on Mon Mar 31 22:03:00 GMT 2025 , Edited by admin on Mon Mar 31 22:03:00 GMT 2025

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PUBCHEM

75647

Created by admin on Mon Mar 31 22:03:00 GMT 2025 , Edited by admin on Mon Mar 31 22:03:00 GMT 2025

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EPA CompTox

DTXSID40179840

Created by admin on Mon Mar 31 22:03:01 GMT 2025 , Edited by admin on Mon Mar 31 22:03:01 GMT 2025

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