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Examples:
iron*
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InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
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ChEBI
> Main
CHEBI:35897 - but-3-enoic acid
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ChEBI Name
but-3-enoic acid
ChEBI ID
CHEBI:35897
Definition
That isomer of butenoic acid having the double bond at position C-3.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C4H6O2
Net Charge
0
Average Mass
86.08924
Monoisotopic Mass
86.03678
InChI
InChI=1S/C4H6O2/c1-2-3-4(5)6/h2H,1,3H2,(H,5,6)
InChIKey
PVEOYINWKBTPIZ-UHFFFAOYSA-N
SMILES
OC(=O)CC=C
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
but-3-enoic acid (
CHEBI:35897
)
is a
butenoic acid (
CHEBI:22959
)
but-3-enoic acid (
CHEBI:35897
)
is conjugate acid of
but-3-enoate (
CHEBI:35900
)
Incoming
(3
E
)-4-(5-amino-2-hydroxyphenyl)-2-oxobut-3-enoic acid (
CHEBI:18558
)
has functional parent
but-3-enoic acid (
CHEBI:35897
)
3-isopropylbut-3-enoic acid (
CHEBI:20092
)
has functional parent
but-3-enoic acid (
CHEBI:35897
)
4-(2-carboxyphenyl)-2-oxobut-3-enoic acid (
CHEBI:49223
)
has functional parent
but-3-enoic acid (
CHEBI:35897
)
cis
-4-(1-hydroxy-2-naphthyl)-2-oxobut-3-enoic acid (
CHEBI:29011
)
has functional parent
but-3-enoic acid (
CHEBI:35897
)
N
-vinylacetylglycine (
CHEBI:74435
)
has functional parent
but-3-enoic acid (
CHEBI:35897
)
but-3-enoate (
CHEBI:35900
)
is conjugate base of
but-3-enoic acid (
CHEBI:35897
)
IUPAC Name
but-3-enoic acid
Synonyms
Sources
2-propenylcarboxylic acid
ChEBI
3-buten-1-oic acid
ChEBI
3-butenoic acid
ChemIDplus
3-butenoic acid
ChEBI
allylic acid
ChEBI
β-butenoic acid
NIST Chemistry WebBook
ethenylacetic acid
ChemIDplus
vinyl acetic acid
ChEBI
vinylacetic acid
Note: (2007-10-19) Should not be confused with vinyl acetate (CHEBI:46916).
ChemIDplus
Vinylessigsäure
ChEBI
Manual Xref
Database
LMFA01030004
LIPID MAPS
View more database links
Registry Numbers
Types
Sources
1699159
Reaxys Registry Number
Reaxys
362641
Gmelin Registry Number
Gmelin
625-38-7
CAS Registry Number
ChemIDplus
625-38-7
CAS Registry Number
NIST Chemistry WebBook
Last Modified
02 July 2013