BUTYL PHENYL KETONE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C11H14O
Molecular Weight	162.2283
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of BUTYL PHENYL KETONE

Structure Search

SMILES

CCCCC(=O)C1=CC=CC=C1

InChI

InChIKey=XKGLSKVNOSHTAD-UHFFFAOYSA-N

InChI=1S/C11H14O/c1-2-3-9-11(12)10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3

HIDE SMILES / InChI

Molecular Formula	C11H14O
Molecular Weight	162.2283
Charge	0
Count

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

Approval Year

PubMed

PubMed

Title	Date	PubMed
Inhibition of carbonyl reductase activity in pig heart by alkyl phenyl ketones.	2007 Feb	17373555

Substance Class	Chemical Created by `admin` on `Fri Dec 15 19:34:01 GMT 2023` Edited by `admin` on `Fri Dec 15 19:34:01 GMT 2023`
Record UNII	F27Q043NT1
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

BUTYL PHENYL KETONE

Systematic Name

English

1-PENTANONE, 1-PHENYL-

Systematic Name

English

PENTANOPHENONE

Systematic Name

English

VALEROPHENONE

Systematic Name

English

NSC-58959

Code

English

Code System Code Type Description

FDA UNII

F27Q043NT1

Created by admin on Fri Dec 15 19:34:01 GMT 2023 , Edited by admin on Fri Dec 15 19:34:01 GMT 2023

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NSC

58959

Created by admin on Fri Dec 15 19:34:01 GMT 2023 , Edited by admin on Fri Dec 15 19:34:01 GMT 2023

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ECHA (EC/EINECS)

213-767-3

Created by admin on Fri Dec 15 19:34:01 GMT 2023 , Edited by admin on Fri Dec 15 19:34:01 GMT 2023

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PUBCHEM

66093

Created by admin on Fri Dec 15 19:34:01 GMT 2023 , Edited by admin on Fri Dec 15 19:34:01 GMT 2023

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CHEBI

36812

Created by admin on Fri Dec 15 19:34:01 GMT 2023 , Edited by admin on Fri Dec 15 19:34:01 GMT 2023

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CAS

1009-14-9

Created by admin on Fri Dec 15 19:34:01 GMT 2023 , Edited by admin on Fri Dec 15 19:34:01 GMT 2023

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WIKIPEDIA

VALEROPHENONE

Created by admin on Fri Dec 15 19:34:01 GMT 2023 , Edited by admin on Fri Dec 15 19:34:01 GMT 2023

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EPA CompTox

DTXSID0061406

Created by admin on Fri Dec 15 19:34:01 GMT 2023 , Edited by admin on Fri Dec 15 19:34:01 GMT 2023

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