Name: Name:3-(5-amino-1H-1,2,3,4-tetrazol-1-yl)benzoic acid
Brand: Angene
SKU: AG01B6T1
Rating: 90 (10 reviews)

3-(5-amino-1H-1,2,3,4-tetrazol-1-yl)benzoic acid

CAS No.:

1989671-38-6

Catalog Number:

AG01B6T1

Molecular Formula:

C8H7N5O2

Molecular Weight:

205.1735

Catalog Number:

AG01B6T1

Chemical Name:

3-(5-amino-1H-1,2,3,4-tetrazol-1-yl)benzoic acid

CAS Number:

1989671-38-6

Molecular Formula:

C8H7N5O2

Molecular Weight:

205.1735

MDL Number:

MFCD30342932

IUPAC Name:

3-(5-aminotetrazol-1-yl)benzoic acid

InChI:

InChI=1S/C8H7N5O2/c9-8-10-11-12-13(8)6-3-1-2-5(4-6)7(14)15/h1-4H,(H,14,15)(H2,9,10,12)

InChI Key:

GWTIQHFZLUPOCY-UHFFFAOYSA-N

SMILES:

OC(=O)c1cccc(c1)n1nnnc1N

Complexity:

249

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

205.06g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

205.177g/mol

Monoisotopic Mass:

205.06g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

107A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.4