Name: Name:3-(3-fluorophenyl)-2-(5-methyl-1H-1,2,3,4-tetrazol-1-yl)propanoic acid
Brand: Angene
SKU: AG019UR2
Rating: 90 (10 reviews)

3-(3-fluorophenyl)-2-(5-methyl-1H-1,2,3,4-tetrazol-1-yl)propanoic acid

CAS No.:

1118787-20-4

Catalog Number:

AG019UR2

Molecular Formula:

C11H11FN4O2

Molecular Weight:

250.2290

Catalog Number:

AG019UR2

Chemical Name:

3-(3-fluorophenyl)-2-(5-methyl-1H-1,2,3,4-tetrazol-1-yl)propanoic acid

CAS Number:

1118787-20-4

Molecular Formula:

C11H11FN4O2

Molecular Weight:

250.2290

MDL Number:

MFCD11857919

IUPAC Name:

3-(3-fluorophenyl)-2-(5-methyltetrazol-1-yl)propanoic acid

InChI:

InChI=1S/C11H11FN4O2/c1-7-13-14-15-16(7)10(11(17)18)6-8-3-2-4-9(12)5-8/h2-5,10H,6H2,1H3,(H,17,18)

InChI Key:

FFHIYWWUHFXPBD-UHFFFAOYSA-N

SMILES:

OC(=O)C(n1nnnc1C)Cc1cccc(c1)F

Complexity:

305

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

250.087g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

250.233g/mol

Monoisotopic Mass:

250.087g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

80.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8