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Details

Stereochemistry ACHIRAL
Molecular Formula C5H8O
Molecular Weight 84.1164
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SENECIALDEHYDE

SMILES

CC(C)=CC=O

InChI

InChIKey=SEPQTYODOKLVSB-UHFFFAOYSA-N
InChI=1S/C5H8O/c1-5(2)3-4-6/h3-4H,1-2H3

HIDE SMILES / InChI

Molecular Formula C5H8O
Molecular Weight 84.1164
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
3-Methylbutanoyl and 3-methylbut-2-enoyl disaccharides from green coffee beans (Coffea arabica).
2002 Jun
Kinetics and products of the OH radical-initiated reaction of 3-methyl-2-butenal.
2005 Jun 7
Thematic review series: lipid posttranslational modifications. Lysosomal metabolism of lipid-modified proteins.
2006 Jul
Organocatalytic asymmetric robinson annulation of alpha,beta-unsaturated aldehydes: applications to the total synthesis of (+)-palitantin.
2007 Oct 26
Kinetics and mechanism of protein tyrosine phosphatase 1B inactivation by acrolein.
2007 Sep
Identification of a novel abscisic acid-regulated farnesol dehydrogenase from Arabidopsis.
2010 Nov
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 19:52:22 GMT 2023
Edited
by admin
on Fri Dec 15 19:52:22 GMT 2023
Record UNII
2JZ2B60W76
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SENECIALDEHYDE
MI  
Systematic Name English
.BETA.-METHYLCROTONALDEHYDE
Systematic Name English
2-BUTENAL, 3-METHYL-
Systematic Name English
.BETA.,.BETA.-DIMETHYLACROLEIN
Common Name English
NSC-149164
Code English
FEMA NO. 3646
Code English
PRENAL
Common Name English
.BETA.,.BETA.-DIMETHYLACRYLIC ALDEHYDE
Common Name English
CROTONALDEHYDE, 3-METHYL-
Systematic Name English
3-METHYL-2-BUTEN-1-AL
Systematic Name English
SENECIALDEHYDE [MI]
Common Name English
3-METHYL-2-BUTENAL [FHFI]
Common Name English
2-METHYL-2-BUTEN-4-AL
Systematic Name English
3-METHYL-2-BUTENAL
FHFI  
Systematic Name English
3,3-DIMETHYLACROLEIN
Systematic Name English
3-METHYL-2-BUTENALDEHYDE
Systematic Name English
3-METHYLCROTONALDEHYDE
Systematic Name English
Classification Tree Code System Code
JECFA EVALUATION 3-METHYL-2-BUTENAL
Created by admin on Fri Dec 15 19:52:22 GMT 2023 , Edited by admin on Fri Dec 15 19:52:22 GMT 2023
Code System Code Type Description
MESH
C544930
Created by admin on Fri Dec 15 19:52:22 GMT 2023 , Edited by admin on Fri Dec 15 19:52:22 GMT 2023
PRIMARY
FDA UNII
2JZ2B60W76
Created by admin on Fri Dec 15 19:52:22 GMT 2023 , Edited by admin on Fri Dec 15 19:52:22 GMT 2023
PRIMARY
ECHA (EC/EINECS)
203-527-6
Created by admin on Fri Dec 15 19:52:22 GMT 2023 , Edited by admin on Fri Dec 15 19:52:22 GMT 2023
PRIMARY
MERCK INDEX
m9857
Created by admin on Fri Dec 15 19:52:22 GMT 2023 , Edited by admin on Fri Dec 15 19:52:22 GMT 2023
PRIMARY Merck Index
NSC
149164
Created by admin on Fri Dec 15 19:52:22 GMT 2023 , Edited by admin on Fri Dec 15 19:52:22 GMT 2023
PRIMARY
EPA CompTox
DTXSID8029606
Created by admin on Fri Dec 15 19:52:22 GMT 2023 , Edited by admin on Fri Dec 15 19:52:22 GMT 2023
PRIMARY
CHEBI
15825
Created by admin on Fri Dec 15 19:52:22 GMT 2023 , Edited by admin on Fri Dec 15 19:52:22 GMT 2023
PRIMARY
CAS
107-86-8
Created by admin on Fri Dec 15 19:52:22 GMT 2023 , Edited by admin on Fri Dec 15 19:52:22 GMT 2023
PRIMARY
PUBCHEM
61020
Created by admin on Fri Dec 15 19:52:22 GMT 2023 , Edited by admin on Fri Dec 15 19:52:22 GMT 2023
PRIMARY
JECFA MONOGRAPH
1211
Created by admin on Fri Dec 15 19:52:22 GMT 2023 , Edited by admin on Fri Dec 15 19:52:22 GMT 2023
PRIMARY