OEL
Occupational Exposure Limits Database
Dapagliflozin dihydrate
CAS Number: 1436389-56-8
IUPAC name: (3R,4R,5S,6R)-2-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol;dihydrate
Molecular formula: C21H29ClO8
Molecular weight: 444.9
InChI: InChI=1S/C21H25ClO6.2H2O/c1-2-27-15-6-3-12(4-7-15)9-14-10-13(5-8-16(14)22)21-20(26)19(25)18(24)17(11-23)28-21;;/h3-8,10,17-21,23-26H,2,9,11H2,1H3;2*1H2/t17-,18-,19+,20-,21?;;/m1../s1
InChIKey: RRUQYMDOFNECAM-RFSZPCNPSA-N
SMILES: CCOC1=CC=C(C=C1)CC2=C(C=CC(=C2)C3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)Cl.O.O
EINECS: -
