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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:27444 - but-3-yn-1-ol
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ChEBI Name
but-3-yn-1-ol
ChEBI ID
CHEBI:27444
Definition
A terminal acetylenic compound that is but-1-yne with one of the methyl hydrogens substituted by a hydroxy group.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:1460, CHEBI:19969
Supplier Information
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Formula
C4H6O
Net Charge
0
Average Mass
70.08980
Monoisotopic Mass
70.04186
InChI
InChI=1S/C4H6O/c1-2-3-4-5/h1,5H,3-4H2
InChIKey
OTJZCIYGRUNXTP-UHFFFAOYSA-N
SMILES
OCCC#C
ChEBI Ontology
Outgoing
but-3-yn-1-ol (
CHEBI:27444
)
is a
butyn-1-ols (
CHEBI:22967
)
but-3-yn-1-ol (
CHEBI:27444
)
is a
terminal acetylenic compound (
CHEBI:73477
)
Incoming
α-
D
-Gal
p
-(1→3)-β-
D
-Gal
p
-(1→4)-β-
D
-Glc
p
NAcO[CH
2
]
2
C≡CH (
CHEBI:131457
)
has functional parent
but-3-yn-1-ol (
CHEBI:27444
)
but-3-yn-1-yl β-
D
-glucoside (
CHEBI:131455
)
has functional parent
but-3-yn-1-ol (
CHEBI:27444
)
IUPAC Name
but-3-yn-1-ol
Synonyms
Sources
1-butyn-4-ol
NIST Chemistry WebBook
3-Butyn-1-ol
KEGG COMPOUND
3-butynol
NIST Chemistry WebBook
3-butynyl alcohol
NIST Chemistry WebBook
4-hydroxy-1-butyne
NIST Chemistry WebBook
4-hydroxy-but-1-yne
ChEBI
but-3-yn-1-ol
UniProt
ethynylmethyl carbinol
ChEBI
homopropargyl alcohol
ChEBI
Manual Xrefs
Databases
C06146
KEGG COMPOUND
CH680439
Patent
View more database links
Registry Numbers
Types
Sources
773710
Beilstein Registry Number
Beilstein
773710
Reaxys Registry Number
Reaxys
927-74-2
CAS Registry Number
ChemIDplus
927-74-2
CAS Registry Number
NIST Chemistry WebBook
Citation
Type
Source
17434192
PubMed citation
Europe PMC
Last Modified
07 March 2016