200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1294481-79-0
1294481-79-0 | D-erythro-Pentonic acid, 2-deoxy-2-fluoro-2-methyl-, γ-lactone, 3,5-bis(4-chlorobenzoate), (2R)-
CAS No: 1294481-79-0 Catalog No: AG000Z4S MDL No:MFCD23106241
Product Description
Catalog Number:
AG000Z4S
Chemical Name:
D-erythro-Pentonic acid, 2-deoxy-2-fluoro-2-methyl-, γ-lactone, 3,5-bis(4-chlorobenzoate), (2R)-
CAS Number:
1294481-79-0
Molecular Formula:
C20H15Cl2FO6
Molecular Weight:
441.2339
MDL Number:
MFCD23106241
IUPAC Name:
[(2R,3R,4R)-3-(4-chlorobenzoyl)oxy-4-fluoro-4-methyl-5-oxooxolan-2-yl]methyl 4-chlorobenzoate
InChI:
InChI=1S/C20H15Cl2FO6/c1-20(23)16(29-18(25)12-4-8-14(22)9-5-12)15(28-19(20)26)10-27-17(24)11-2-6-13(21)7-3-11/h2-9,15-16H,10H2,1H3/t15-,16-,20-/m1/s1
InChI Key:
CTNZBYHJBWVNHD-JXXFODFXSA-N
SMILES:
Clc1ccc(cc1)C(=O)OC[C@H]1OC(=O)[C@]([C@@H]1OC(=O)c1ccc(cc1)Cl)(C)F
Properties
Complexity:
631
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
440.023g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
441.232g/mol
Monoisotopic Mass:
440.023g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.