Name: Name:4,4,4-trifluoro-3-hydroxy-3-(1H-imidazol-2-yl)butanoic acid
Brand: Angene
SKU: AG019XAK
Rating: 90 (10 reviews)

4,4,4-trifluoro-3-hydroxy-3-(1H-imidazol-2-yl)butanoic acid

CAS No.:

1211096-65-9

Catalog Number:

AG019XAK

Molecular Formula:

C7H7F3N2O3

Molecular Weight:

224.1373

Catalog Number:

AG019XAK

Chemical Name:

4,4,4-trifluoro-3-hydroxy-3-(1H-imidazol-2-yl)butanoic acid

CAS Number:

1211096-65-9

Molecular Formula:

C7H7F3N2O3

Molecular Weight:

224.1373

MDL Number:

MFCD13196079

IUPAC Name:

4,4,4-trifluoro-3-hydroxy-3-(1H-imidazol-2-yl)butanoic acid

InChI:

InChI=1S/C7H7F3N2O3/c8-7(9,10)6(15,3-4(13)14)5-11-1-2-12-5/h1-2,15H,3H2,(H,11,12)(H,13,14)

InChI Key:

DOSITXNCMGQCHR-UHFFFAOYSA-N

SMILES:

OC(=O)CC(C(F)(F)F)(c1ncc[nH]1)O

Complexity:

258

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

224.041g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

224.139g/mol

Monoisotopic Mass:

224.041g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

86.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.3