Name: Name:3-(4H-1,2,4-triazol-3-yl)propanoic acid
Brand: Angene
SKU: AG01E8IA
Rating: 90 (10 reviews)

3-(4H-1,2,4-triazol-3-yl)propanoic acid

CAS No.:

844439-07-2

Catalog Number:

AG01E8IA

Molecular Formula:

C5H7N3O2

Molecular Weight:

141.1280

Catalog Number:

AG01E8IA

Chemical Name:

3-(4H-1,2,4-triazol-3-yl)propanoic acid

CAS Number:

844439-07-2

Molecular Formula:

C5H7N3O2

Molecular Weight:

141.1280

MDL Number:

MFCD22056410

IUPAC Name:

3-(1H-1,2,4-triazol-5-yl)propanoic acid

InChI:

InChI=1S/C5H7N3O2/c9-5(10)2-1-4-6-3-7-8-4/h3H,1-2H2,(H,9,10)(H,6,7,8)

InChI Key:

SIEANLUVCPATRT-UHFFFAOYSA-N

SMILES:

OC(=O)CCc1nnc[nH]1

Complexity:

128

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

141.054g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

141.13g/mol

Monoisotopic Mass:

141.054g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

78.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.2