Name: Name:2-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)amino]butanoic acid
Brand: Angene
SKU: AG01AABJ
Rating: 90 (10 reviews)

2-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)amino]butanoic acid

CAS No.:

1218314-52-3

Catalog Number:

AG01AABJ

Molecular Formula:

C11H13N5O2

Molecular Weight:

247.2532

Catalog Number:

AG01AABJ

Chemical Name:

2-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)amino]butanoic acid

CAS Number:

1218314-52-3

Molecular Formula:

C11H13N5O2

Molecular Weight:

247.2532

MDL Number:

MFCD12071845

IUPAC Name:

2-[(1-phenyltetrazol-5-yl)amino]butanoic acid

InChI:

InChI=1S/C11H13N5O2/c1-2-9(10(17)18)12-11-13-14-15-16(11)8-6-4-3-5-7-8/h3-7,9H,2H2,1H3,(H,17,18)(H,12,13,15)

InChI Key:

JYCXIIPTSPNNAL-UHFFFAOYSA-N

SMILES:

CCC(C(=O)O)Nc1nnnn1c1ccccc1

Complexity:

283

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

247.107g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

247.258g/mol

Monoisotopic Mass:

247.107g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

92.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1