4,4-BIS(4-HYDROXYPHENYL)-3-HEXANONE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C18H20O3
Molecular Weight	284.3496
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4,4-BIS(4-HYDROXYPHENYL)-3-HEXANONE

Structure Search

SMILES

CCC(=O)C(CC)(C1=CC=C(O)C=C1)C2=CC=C(O)C=C2

InChI

InChIKey=VXQMNZNWFJLHAO-UHFFFAOYSA-N

InChI=1S/C18H20O3/c1-3-17(21)18(4-2,13-5-9-15(19)10-6-13)14-7-11-16(20)12-8-14/h5-12,19-20H,3-4H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C18H20O3
Molecular Weight	284.3496
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 `Sat Dec 16 12:54:47 GMT 2023` Edited by `admin` on `Sat Dec 16 12:54:47 GMT 2023`
Record UNII	3X2BX5I3ZZ
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

4,4-BIS(4-HYDROXYPHENYL)-3-HEXANONE

Systematic Name

English

NSC-408851

Code

English

3-HEXANONE, 4,4-BIS(P-HYDROXYPHENYL)-

Systematic Name

English

3-HEXANONE, 4,4-BIS(4-HYDROXYPHENYL)-

Systematic Name

English

DIETHYLSTILBESTROL PINACOLONE

Systematic Name

English

Code System Code Type Description

PUBCHEM

101371

Created by admin on Sat Dec 16 12:54:47 GMT 2023 , Edited by admin on Sat Dec 16 12:54:47 GMT 2023

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NSC

408851

Created by admin on Sat Dec 16 12:54:47 GMT 2023 , Edited by admin on Sat Dec 16 12:54:47 GMT 2023

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FDA UNII

3X2BX5I3ZZ

Created by admin on Sat Dec 16 12:54:47 GMT 2023 , Edited by admin on Sat Dec 16 12:54:47 GMT 2023

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EPA CompTox

DTXSID80940435

Created by admin on Sat Dec 16 12:54:47 GMT 2023 , Edited by admin on Sat Dec 16 12:54:47 GMT 2023

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CAS

18922-13-9

Created by admin on Sat Dec 16 12:54:47 GMT 2023 , Edited by admin on Sat Dec 16 12:54:47 GMT 2023

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