Name: Name:1-(4-aminophenyl)-4-methyl-4,5-dihydro-1H-1,2,4-triazol-5-one
Brand: Angene
SKU: AG01A36U
Rating: 90 (10 reviews)

1-(4-aminophenyl)-4-methyl-4,5-dihydro-1H-1,2,4-triazol-5-one

CAS No.:

1427380-50-4

Catalog Number:

AG01A36U

Molecular Formula:

C9H10N4O

Molecular Weight:

190.2019

Catalog Number:

AG01A36U

Chemical Name:

1-(4-aminophenyl)-4-methyl-4,5-dihydro-1H-1,2,4-triazol-5-one

CAS Number:

1427380-50-4

Molecular Formula:

C9H10N4O

Molecular Weight:

190.2019

MDL Number:

MFCD23144004

IUPAC Name:

2-(4-aminophenyl)-4-methyl-1,2,4-triazol-3-one

InChI:

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

InChI Key:

UCUUMSPCFOUBHC-UHFFFAOYSA-N

SMILES:

Nc1ccc(cc1)n1ncn(c1=O)C

Complexity:

258

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