Name: Name:(2R,3R)-2-(2,4-Difluorophenyl)-1-(1H-1,2,4-triazol-1-yl)butane-2,3-diol
Brand: Angene
SKU: AG0039UG
Rating: 90 (10 reviews)

(2R,3R)-2-(2,4-Difluorophenyl)-1-(1H-1,2,4-triazol-1-yl)butane-2,3-diol

CAS No.:

133775-25-4

Catalog Number:

AG0039UG

Molecular Formula:

C12H13F2N3O2

Molecular Weight:

269.2473

Catalog Number:

AG0039UG

Chemical Name:

(2R,3R)-2-(2,4-Difluorophenyl)-1-(1H-1,2,4-triazol-1-yl)butane-2,3-diol

CAS Number:

133775-25-4

Molecular Formula:

C12H13F2N3O2

Molecular Weight:

269.2473

IUPAC Name:

(2R,3R)-2-(2,4-difluorophenyl)-1-(1,2,4-triazol-1-yl)butane-2,3-diol

InChI:

InChI=1S/C12H13F2N3O2/c1-8(18)12(19,5-17-7-15-6-16-17)10-3-2-9(13)4-11(10)14/h2-4,6-8,18-19H,5H2,1H3/t8-,12-/m1/s1

InChI Key:

LSCNANBNVFQJDJ-PRHODGIISA-N

SMILES:

Fc1ccc(c(c1)F)[C@]([C@H](O)C)(Cn1cncn1)O

Complexity:

311

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

269.098g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

269.252g/mol

Monoisotopic Mass:

269.098g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

71.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.4