Name: Name:2-(4-phenyl-4H-1,2,4-triazol-3-yl)acetonitrile
Brand: Angene
SKU: AG01BDCX
Rating: 90 (10 reviews)

2-(4-phenyl-4H-1,2,4-triazol-3-yl)acetonitrile

CAS No.:

77691-67-9

Catalog Number:

AG01BDCX

Molecular Formula:

C10H8N4

Molecular Weight:

184.1973

Catalog Number:

AG01BDCX

Chemical Name:

2-(4-phenyl-4H-1,2,4-triazol-3-yl)acetonitrile

CAS Number:

77691-67-9

Molecular Formula:

C10H8N4

Molecular Weight:

184.1973

MDL Number:

MFCD00524779

IUPAC Name:

2-(4-phenyl-1,2,4-triazol-3-yl)acetonitrile

InChI:

InChI=1S/C10H8N4/c11-7-6-10-13-12-8-14(10)9-4-2-1-3-5-9/h1-5,8H,6H2

InChI Key:

RRPFZMYBUYBHOY-UHFFFAOYSA-N

SMILES:

N#CCc1nncn1c1ccccc1

Complexity:

226

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

184.075g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

184.202g/mol

Monoisotopic Mass:

184.075g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

54.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8