4-PHENYL-2-BUTANONE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H12O
Molecular Weight	148.2017
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

SMILES

CC(=O)CCC1=CC=CC=C1

InChI

InChIKey=AKGGYBADQZYZPD-UHFFFAOYSA-N

InChI=1S/C10H12O/c1-9(11)7-8-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3

HIDE SMILES / InChI

Molecular Formula	C10H12O
Molecular Weight	148.2017
Charge	0
Count	MOL RATIO 1 MOL RATIO (average)

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

Approval Year

PubMed

Show entries

Title	Date	PubMed
Influence of the N-B transition of human serum albumin on the structure of the warfarin-binding site.	1987 Sep 24	3651475
Dorycnioside, a new phenylbutanone glucoside from Dorycnium pentaphyllum subsp. herbaceum.	2004 Jan-Feb	15018046
ISSR and AFLP analysis of the temporal and spatial population structure of the post-fire annual, Nicotiana attenuata, in SW Utah.	2004 Sep 6	15350209
Antioxidant and free radical scavenging activities of Misodendrum punctulatum, myzodendrone and structurally related phenols.	2005 Dec	16372370
Dakin-West synthesis of beta-aryl ketones.	2006 Aug 18	16901161

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Patents

Substance Class	Chemical
Record UNII	UZM5QH16YW
Record Status	`Validated (UNII)`
Record Version

Show entries

Name

Type

Language

4-PHENYL-2-BUTANONE

Systematic Name

English

2-PHENYLETHYL METHYL KETONE

Systematic Name

English

1-PHENYL-3-BUTANONE

Systematic Name

English

2-BUTANONE, 4-PHENYL-

Systematic Name

English

NSC-44829

Code

English

Showing 1 to 5 of 11 entries

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Show entries

Code System

Code

Type

Description

SMS_ID

100000171967

PRIMARY

CAS

2550-26-7

PRIMARY

FDA UNII

UZM5QH16YW

PRIMARY

EPA CompTox

DTXSID6033241

PRIMARY

WIKIPEDIA

Benzylacetone

PRIMARY

Showing 1 to 5 of 9 entries

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