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Structure

3-(1H-1,2,4-Triazol-1-yl)-2-butanone

CAS
106836-80-0
Catalog Number
ACM106836800
Category
Other Products
Molecular Weight
139.16
Molecular Formula
C6H9N3O

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Specification

Synonyms
106836-80-0, 3-(1,2,4-triazol-1-yl)butan-2-one, 1-(3-Oxobut-2-yl)-1H-1,2,4-triazole, triazolylbutanone, AC1MCFTW, SureCN9366536, CTK4A4793, MolPort-001-758-456, 3-(1,2,4-triazolyl)butan-2-one, SBB086072, AKOS005069567, AG-D-21520, MCULE-7788864823, RP09802, 3-(1H-1,2,4-Triazol-1-yl)-2-butanone, FT-0680057, 12E-009, (3R)-3-(1H-1,2,4-triazol-1-yl)butan-2-one, (3S)-3-(1H-1,2,4-triazol-1-yl)butan-2-one, I14-25638
IUPAC Name
3-(1,2,4-triazol-1-yl)butan-2-one
Canonical SMILES
CC(C(=O)C)N1C=NC=N1
InChI Key
LFAGOYHWDZARPP-UHFFFAOYSA-N
Boiling Point
93-95ºC/0.38mm
Flash Point
113ºC
Density
1.19g/cm³
Exact Mass
139.07500
Hazard Statements
Xi
H-Bond Acceptor
3
H-Bond Donor
0
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