2-(1H-1,2,4-Triazol-1-yl)acetonitrile

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Catalog Number
ACM81606793
Product Name
2-(1H-1,2,4-Triazol-1-yl)acetonitrile
Structure
Structure
CAS
81606-79-3
Category
Heterocyclic Organic Compound
Synonyms
MolPort-000-876-326, ZINC02569385, CID2764838, 10E-060, 81606-79-3
IUPAC Name
2-(1,2,4-triazol-1-yl)acetonitrile
Molecular Weight
108.1
Molecular Formula
C4H4N4
Canonical SMILES
C1=NN(C=N1)CC#N
InChI Key
ZEDZBEBBGBQWBP-UHFFFAOYSA-N
Boiling Point
312.9ºC at 760 mmHg
Melting Point
55-58ºC
Flash Point
143ºC
Density
1.27g/cm³
Exact Mass
108.04400
H-Bond Acceptor
3
H-Bond Donor
0
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