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1R-Dapagliflozin
[CAS# 1373321-04-0]

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Identification
Name 1R-Dapagliflozin
Synonyms (2R,3R,4R,5S,6R)-2-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol
Molecular Structure CAS # 1373321-04-0, 1R-Dapagliflozin, (2R,3R,4R,5S,6R)-2-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol
Molecular Formula C21H25ClO6
Molecular Weight 408.87
CAS Registry Number 1373321-04-0
EC Number 959-392-5
SMILES CCOC1=CC=C(C=C1)CC2=C(C=CC(=C2)[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)Cl
Properties
Density 1.3±0.1 g/cm3, Calc.*
Index of Refraction 1.614, Calc.*
Boiling Point 609.0±55.0 ºC (760 mmHg), Calc.*
Flash Point 322.1±31.5 ºC, Calc.*
* Calculated using Advanced Chemistry Development (ACD/Labs) Software.
Safety Data
Hazard Symbols symbol   GHS07 Warning    Details
Hazard Statements H302-H315-H319-H335    Details
Precautionary Statements P261-P264-P280-P301+P312-P305+P351+P338    Details
Hazard Classification
up    Details
HazardClassCategory CodeHazard Statement
Eye irritationEye Irrit.2H319
Specific target organ toxicity - single exposureSTOT SE3H335
Acute toxicityAcute Tox.4H302
Skin irritationSkin Irrit.2H315
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