CS-0379686
(2S,3R,4S,5R,6R)-6-(Acetoxymethyl)-2-(4-chloro-3-(4-ethoxybenzyl)phenyl)-2-methoxytetrahydro-2H-pyran-3,4,5-triyl triacetate Dapagliflozin Impurity
Manufacturer: ChemScene
CAS Number: 714269-58-6
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₃₀H₃₅ClO₁₁
Molecular Weight
607.05
Synonyms
α-D-Glucopyranoside, methyl 1-C-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-, 2,3,4,6-tetraacetate
SMILES
CO[C@]1(C2=CC(CC3=CC=C(C=C3)OCC)=C(C=C2)Cl)[C@@H]([C@H]([C@@H]([C@H](O1)COC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O
Tpsa
132.89
Logp
3.8857
H Acceptors
11
H Donors
0
Rotatable Bonds
11
SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₀H₃₅ClO₁₁
Molecular Weight: 607.05
Synonyms: α-D-Glucopyranoside, methyl 1-C-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-, 2,3,4,6-tetraacetate
SMILES: CO[C@]1(C2=CC(CC3=CC=C(C=C3)OCC)=C(C=C2)Cl)[C@@H]([C@H]([C@@H]([C@H](O1)COC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O
Tpsa: 132.89
Logp: 3.8857
H Acceptors: 11
H Donors: 0
Rotatable Bonds: 11
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₀H₃₅ClO₁₁
Molecular Weight:
607.05
Synonyms:
α-D-Glucopyranoside, methyl 1-C-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-, 2,3,4,6-tetraacetate
SMILES:
CO[C@]1(C2=CC(CC3=CC=C(C=C3)OCC)=C(C=C2)Cl)[C@@H]([C@H]([C@@H]([C@H](O1)COC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O
Tpsa:
132.89
Logp:
3.8857
H Acceptors:
11
H Donors:
0
Rotatable Bonds:
11
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₁₀ClF₂NO₂
Molecular Weight: 189.59
Synonyms: 3-(Dimethylamino)-2,2-difluoropropanoic acid; hydrochloride
SMILES: O=C(O)C(F)(F)CN(C)C.[H]Cl
Tpsa: 40.54
Logp: 0.6897
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₁₀ClF₂NO₂
Molecular Weight:
189.59
Synonyms:
3-(Dimethylamino)-2,2-difluoropropanoic acid; hydrochloride
SMILES:
O=C(O)C(F)(F)CN(C)C.[H]Cl
Tpsa:
40.54
Logp:
0.6897
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₁₁F₂NO
Molecular Weight: 139.14
Synonyms: None
SMILES: OCC(F)(F)CN(C)C
Tpsa: 23.47
Logp: 0.1756
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₁₁F₂NO
Molecular Weight:
139.14
Synonyms:
None
SMILES:
OCC(F)(F)CN(C)C
Tpsa:
23.47
Logp:
0.1756
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: MFCD30718687
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₁₈O₅
Molecular Weight: 278.30
Synonyms: Loxoprofen sodium degrades impurity B
SMILES: O=C(CCCC(CC1=CC=C(C=C1)C(C)C(O)=O)=O)O
Tpsa: 91.67
Logp: 2.2412
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 8
Purity:
98%
MDL No:
MFCD30718687
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₁₈O₅
Molecular Weight:
278.30
Synonyms:
Loxoprofen sodium degrades impurity B
SMILES:
O=C(CCCC(CC1=CC=C(C=C1)C(C)C(O)=O)=O)O
Tpsa:
91.67
Logp:
2.2412
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
8