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

CAS

81606-79-3

Catalog Number

ACM81606793

Category

Other Products

Molecular Weight

108.1

Molecular Formula

C₄H₄N₄

MSDS COA Spec Sheet

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Specification

Synonyms

MolPort-000-876-326, ZINC02569385, CID2764838, 10E-060, 81606-79-3

IUPAC Name

2-(1,2,4-triazol-1-yl)acetonitrile

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

H-Bond Donor

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