Name: Name:1-(3-aminophenyl)-4,5-dihydro-1H-1,2,3,4-tetrazol-5-one
Brand: Angene
SKU: AG01EI6P
Rating: 90 (10 reviews)

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

CAS No.:

1016505-50-2

Catalog Number:

AG01EI6P

Molecular Formula:

C7H7N5O

Molecular Weight:

177.1634

Catalog Number:

AG01EI6P

Chemical Name:

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

CAS Number:

1016505-50-2

Molecular Formula:

C7H7N5O

Molecular Weight:

177.1634

MDL Number:

MFCD09809060

IUPAC Name:

4-(3-aminophenyl)-1H-tetrazol-5-one

InChI:

InChI=1S/C7H7N5O/c8-5-2-1-3-6(4-5)12-7(13)9-10-11-12/h1-4H,8H2,(H,9,11,13)

InChI Key:

CSPAMNVHAKSASD-UHFFFAOYSA-N

SMILES:

Nc1cccc(c1)n1nn[nH]c1=O

Complexity:

241

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

177.065g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

177.167g/mol

Monoisotopic Mass:

177.065g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

83.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.9