Name: Name:4-(3-aminophenyl)-4,5-dihydro-1H-1,2,4-triazol-5-one
Brand: Angene
SKU: AG01A99S
Rating: 90 (10 reviews)

4-(3-aminophenyl)-4,5-dihydro-1H-1,2,4-triazol-5-one

CAS No.:

1016771-84-8

Catalog Number:

AG01A99S

Molecular Formula:

C8H8N4O

Molecular Weight:

176.1753

Catalog Number:

AG01A99S

Chemical Name:

4-(3-aminophenyl)-4,5-dihydro-1H-1,2,4-triazol-5-one

CAS Number:

1016771-84-8

Molecular Formula:

C8H8N4O

Molecular Weight:

176.1753

MDL Number:

MFCD09933328

IUPAC Name:

4-(3-aminophenyl)-1H-1,2,4-triazol-5-one

InChI:

InChI=1S/C8H8N4O/c9-6-2-1-3-7(4-6)12-5-10-11-8(12)13/h1-5H,9H2,(H,11,13)

InChI Key:

YAJUDAWYSQPFKK-UHFFFAOYSA-N

SMILES:

Nc1cccc(c1)n1cn[nH]c1=O

Complexity:

240

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

176.07g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

176.179g/mol

Monoisotopic Mass:

176.07g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

70.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.3