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Dapagliflozin Impurity 10

CAS No.:
960404-86-8
Catalog Number:
AG01FO13
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01FO13
Chemical Name:
Dapagliflozin Impurity 10
CAS Number:
960404-86-8
IUPAC Name:
(2S)-2-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-6-(hydroxymethyl)oxane-2,3,4,5-tetrol
InChI:
InChI=1S/C21H25ClO7/c1-2-28-15-6-3-12(4-7-15)9-13-10-14(5-8-16(13)22)21(27)20(26)19(25)18(24)17(11-23)29-21/h3-8,10,17-20,23-27H,2,9,11H2,1H3/t17?,18?,19?,20?,21-/m0/s1
InChI Key:
KYDGWGYAUCJZDV-ALAWOQLPSA-N
Properties
Complexity:
515  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
424.129g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
5  
Isotope Atom Count:
0
Molecular Weight:
424.874g/mol
Monoisotopic Mass:
424.129g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
120A^2
Undefined Atom Stereocenter Count:
4  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties