Name: Name:3-amino-1-methyl-4-phenyl-1H-1,2,4-triazol-5(4H)-one
Brand: Angene
SKU: AG01DWBY
Rating: 90 (10 reviews)

3-amino-1-methyl-4-phenyl-1H-1,2,4-triazol-5(4H)-one

CAS No.:

3190-32-7

Catalog Number:

AG01DWBY

Molecular Formula:

C9H10N4O

Molecular Weight:

190.2019

Catalog Number:

AG01DWBY

Chemical Name:

3-amino-1-methyl-4-phenyl-1H-1,2,4-triazol-5(4H)-one

CAS Number:

3190-32-7

Molecular Formula:

C9H10N4O

Molecular Weight:

190.2019

MDL Number:

MFCD20706107

IUPAC Name:

5-amino-2-methyl-4-phenyl-1,2,4-triazol-3-one

InChI:

InChI=1S/C9H10N4O/c1-12-9(14)13(8(10)11-12)7-5-3-2-4-6-7/h2-6H,1H3,(H2,10,11)

InChI Key:

GDJJVMDPIUWOIJ-UHFFFAOYSA-N

SMILES:

Nc1nn(c(=O)n1c1ccccc1)C

Complexity:

270

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

190.085g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

190.206g/mol

Monoisotopic Mass:

190.085g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

61.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.5