U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C10H10O
Molecular Weight 146.1858
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of BENZYLIDENEACETONE

SMILES

CC(=O)\C=C\C1=CC=CC=C1

InChI

InChIKey=BWHOZHOGCMHOBV-BQYQJAHWSA-N
InChI=1S/C10H10O/c1-9(11)7-8-10-5-3-2-4-6-10/h2-8H,1H3/b8-7+

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

TitleDatePubMed
Antigenic competition in the induction of contact sensitivity in the guinea pig.
1985
Parallel induction of heme oxygenase-1 and chemoprotective phase 2 enzymes by electrophiles and antioxidants: regulation by upstream antioxidant-responsive elements (ARE).
1995 Nov
Electrophile and antioxidant regulation of enzymes that detoxify carcinogens.
1995 Sep 12
Antioxidative function and substrate specificity of NAD(P)H-dependent alkenal/one oxidoreductase. A new role for leukotriene B4 12-hydroxydehydrogenase/15-oxoprostaglandin 13-reductase.
2001 Nov 2
The enzymatic asymmetric conjugate umpolung reaction.
2010 Sep 3
Relating skin sensitizing potency to chemical reactivity: reactive Michael acceptors inhibit NF-κB signaling and are less sensitizing than S(N)Ar- and S(N)2- reactive chemicals.
2011 Nov 21
Patents
Name Type Language
BENZYLIDENEACETONE
MI  
Systematic Name English
CINNAMYL METHYL KETONE
Systematic Name English
3-BUTEN-2-ONE, 4-PHENYL-, (E)-
Systematic Name English
BENZYLIDENEACETONE [MI]
Common Name English
METHYL STYRYL KETONE
Systematic Name English
ACETOCINNAMONE
Common Name English
4-PHENYL-3-BUTEN-2-ONE, TRANS
Common Name English
BENZYLIDENEACETONE, (E)-
Systematic Name English
4-PHENYL-3-BUTEN-2-ONE [FHFI]
Common Name English
TRANS-BENZYLIDENEACETONE
Systematic Name English
BENZALACETONE [USP IMPURITY]
Common Name English
(3E)-4-PHENYL-3-BUTEN-2-ONE
Systematic Name English
(3E)-4-PHENYLBUT-3-EN-2-ONE (BENZALACETONE)
Common Name English
BENZALACETONE
Systematic Name English
FEMA NO. 2881
Code English
STYRYL METHYL KETONE
Systematic Name English
3-BUTEN-2-ONE, 4-PHENYL-, (3E)-
Systematic Name English
4-PHENYL-3-BUTEN-2-ONE
FHFI  
Systematic Name English
WARFARIN SODIUM IMPURITY C [EP IMPURITY]
Common Name English
NSC-5605
Code English
METHYL TRANS-STYRYL KETONE
Systematic Name English
Classification Tree Code System Code
JECFA EVALUATION 4-PHENYL-3-BUTEN-2-ONE
Created by admin on Fri Dec 15 18:11:48 GMT 2023 , Edited by admin on Fri Dec 15 18:11:48 GMT 2023
CFR 21 CFR 172.515
Created by admin on Fri Dec 15 18:11:48 GMT 2023 , Edited by admin on Fri Dec 15 18:11:48 GMT 2023
Code System Code Type Description
CHEBI
217301
Created by admin on Fri Dec 15 18:11:48 GMT 2023 , Edited by admin on Fri Dec 15 18:11:48 GMT 2023
PRIMARY
JECFA MONOGRAPH
805
Created by admin on Fri Dec 15 18:11:48 GMT 2023 , Edited by admin on Fri Dec 15 18:11:48 GMT 2023
PRIMARY
ECHA (EC/EINECS)
217-587-6
Created by admin on Fri Dec 15 18:11:48 GMT 2023 , Edited by admin on Fri Dec 15 18:11:48 GMT 2023
PRIMARY
CAS
1896-62-4
Created by admin on Fri Dec 15 18:11:48 GMT 2023 , Edited by admin on Fri Dec 15 18:11:48 GMT 2023
PRIMARY
MERCK INDEX
m2410
Created by admin on Fri Dec 15 18:11:48 GMT 2023 , Edited by admin on Fri Dec 15 18:11:48 GMT 2023
PRIMARY Merck Index
ECHA (EC/EINECS)
204-555-1
Created by admin on Fri Dec 15 18:11:48 GMT 2023 , Edited by admin on Fri Dec 15 18:11:48 GMT 2023
ALTERNATIVE
CHEBI
78399
Created by admin on Fri Dec 15 18:11:48 GMT 2023 , Edited by admin on Fri Dec 15 18:11:48 GMT 2023
PRIMARY
PUBCHEM
637759
Created by admin on Fri Dec 15 18:11:48 GMT 2023 , Edited by admin on Fri Dec 15 18:11:48 GMT 2023
PRIMARY
FDA UNII
B03X40BMT5
Created by admin on Fri Dec 15 18:11:48 GMT 2023 , Edited by admin on Fri Dec 15 18:11:48 GMT 2023
PRIMARY
SMS_ID
300000031242
Created by admin on Fri Dec 15 18:11:48 GMT 2023 , Edited by admin on Fri Dec 15 18:11:48 GMT 2023
PRIMARY
MESH
C025383
Created by admin on Fri Dec 15 18:11:48 GMT 2023 , Edited by admin on Fri Dec 15 18:11:48 GMT 2023
PRIMARY
CAS
122-57-6
Created by admin on Fri Dec 15 18:11:48 GMT 2023 , Edited by admin on Fri Dec 15 18:11:48 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
NSC
5605
Created by admin on Fri Dec 15 18:11:48 GMT 2023 , Edited by admin on Fri Dec 15 18:11:48 GMT 2023
PRIMARY
EPA CompTox
DTXSID1031626
Created by admin on Fri Dec 15 18:11:48 GMT 2023 , Edited by admin on Fri Dec 15 18:11:48 GMT 2023
PRIMARY
WIKIPEDIA
BENZYLIDENEACETONE
Created by admin on Fri Dec 15 18:11:48 GMT 2023 , Edited by admin on Fri Dec 15 18:11:48 GMT 2023
PRIMARY