Name: Name:5H-Tetrazol-5-one, 1-(4-aminophenyl)-1,2-dihydro-
Brand: Angene
SKU: AG01B1G5
Rating: 90 (10 reviews)

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

CAS No.:

99595-73-0

Catalog Number:

AG01B1G5

Molecular Formula:

C7H7N5O

Molecular Weight:

177.1634

Catalog Number:

AG01B1G5

Chemical Name:

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

CAS Number:

99595-73-0

Molecular Formula:

C7H7N5O

Molecular Weight:

177.1634

MDL Number:

MFCD09808298

IUPAC Name:

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

InChI:

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

InChI Key:

OKAOEKKGMDHTRG-UHFFFAOYSA-N

SMILES:

Nc1ccc(cc1)n1nn[nH]c1=O

Complexity:

233

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