Name: Name:3-(5-amino-1,3,4-oxadiazol-2-yl)benzonitrile
Brand: Angene
SKU: AG018MVY
Rating: 90 (10 reviews)

3-(5-amino-1,3,4-oxadiazol-2-yl)benzonitrile

CAS No.:

1016521-87-1

Catalog Number:

AG018MVY

Molecular Formula:

C9H6N4O

Molecular Weight:

186.1701

Catalog Number:

AG018MVY

Chemical Name:

3-(5-amino-1,3,4-oxadiazol-2-yl)benzonitrile

CAS Number:

1016521-87-1

Molecular Formula:

C9H6N4O

Molecular Weight:

186.1701

MDL Number:

MFCD09804065

IUPAC Name:

3-(5-amino-1,3,4-oxadiazol-2-yl)benzonitrile

InChI:

InChI=1S/C9H6N4O/c10-5-6-2-1-3-7(4-6)8-12-13-9(11)14-8/h1-4H,(H2,11,13)

InChI Key:

NBSLHZOUTRJQPP-UHFFFAOYSA-N

SMILES:

N#Cc1cccc(c1)c1nnc(o1)N

Complexity:

248

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

186.054g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

186.174g/mol

Monoisotopic Mass:

186.054g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

88.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8