Name: Name:4-methoxy-3-(1H-1,2,3,4-tetrazol-1-yl)benzoic acid
Brand: Angene
SKU: AG01A5ZG
Rating: 90 (10 reviews)

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

CAS No.:

1083368-79-9

Catalog Number:

AG01A5ZG

Molecular Formula:

C9H8N4O3

Molecular Weight:

220.1848

Catalog Number:

AG01A5ZG

Chemical Name:

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

CAS Number:

1083368-79-9

Molecular Formula:

C9H8N4O3

Molecular Weight:

220.1848

MDL Number:

MFCD18876704

IUPAC Name:

4-methoxy-3-(tetrazol-1-yl)benzoic acid

InChI:

InChI=1S/C9H8N4O3/c1-16-8-3-2-6(9(14)15)4-7(8)13-5-10-11-12-13/h2-5H,1H3,(H,14,15)

InChI Key:

TWBZAJKBINVVPC-UHFFFAOYSA-N

SMILES:

COc1ccc(cc1n1cnnn1)C(=O)O

Complexity:

263

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

220.06g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

220.188g/mol

Monoisotopic Mass:

220.06g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

90.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.7