CS-1003105
Empagliflozin Impurity 274
Manufacturer: ChemScene
CAS Number: 2452301-05-0
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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
C₄₇H₅₄Cl₂O₁₅
Molecular Weight
929.83
Synonyms
None
SMILES
O(C[C@H]1O[C@@](OC)([C@H](O)[C@@H](O)[C@@H]1O)C2=CC(CC3=CC=C(O[C@@H]4CCOC4)C=C3)=C(Cl)C=C2)[C@]5(O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)C6=CC(CC7=CC=C(O[C@@H]8CCOC8)C=C7)=C(Cl)C=C6
Tpsa
215.45
Logp
3.1345
H Acceptors
15
H Donors
7
Rotatable Bonds
15
SAFETY INFORMATION
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: C₄₇H₅₄Cl₂O₁₅
Molecular Weight: 929.83
Synonyms: None
SMILES: O(C[C@H]1O[C@@](OC)([C@H](O)[C@@H](O)[C@@H]1O)C2=CC(CC3=CC=C(O[C@@H]4CCOC4)C=C3)=C(Cl)C=C2)[C@]5(O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)C6=CC(CC7=CC=C(O[C@@H]8CCOC8)C=C7)=C(Cl)C=C6
Tpsa: 215.45
Logp: 3.1345
H Acceptors: 15
H Donors: 7
Rotatable Bonds: 15
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄₇H₅₄Cl₂O₁₅
Molecular Weight:
929.83
Synonyms:
None
SMILES:
O(C[C@H]1O[C@@](OC)([C@H](O)[C@@H](O)[C@@H]1O)C2=CC(CC3=CC=C(O[C@@H]4CCOC4)C=C3)=C(Cl)C=C2)[C@]5(O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)C6=CC(CC7=CC=C(O[C@@H]8CCOC8)C=C7)=C(Cl)C=C6
Tpsa:
215.45
Logp:
3.1345
H Acceptors:
15
H Donors:
7
Rotatable Bonds:
15
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₃H₂₇BrO₇
Molecular Weight: 495.36
Synonyms: None
SMILES: O[C@H]1[C@@H](C2=CC(CC3=CC=C(O[C@@H]4CCOC4)C=C3)=C(Br)C=C2)O[C@H](CO)[C@@H](O)[C@@H]1O
Tpsa: 108.61
Logp: 1.7225
H Acceptors: 7
H Donors: 4
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₃H₂₇BrO₇
Molecular Weight:
495.36
Synonyms:
None
SMILES:
O[C@H]1[C@@H](C2=CC(CC3=CC=C(O[C@@H]4CCOC4)C=C3)=C(Br)C=C2)O[C@H](CO)[C@@H](O)[C@@H]1O
Tpsa:
108.61
Logp:
1.7225
H Acceptors:
7
H Donors:
4
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₁₆BrIO₂
Molecular Weight: 459.12
Synonyms: None
SMILES: C(C1=C(Br)C=CC(I)=C1)C2=CC=C(O[C@H]3CCOC3)C=C2
Tpsa: 18.46
Logp: 4.8122
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₁₆BrIO₂
Molecular Weight:
459.12
Synonyms:
None
SMILES:
C(C1=C(Br)C=CC(I)=C1)C2=CC=C(O[C@H]3CCOC3)C=C2
Tpsa:
18.46
Logp:
4.8122
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₄H₂₇NO₃
Molecular Weight: 377.48
Synonyms: None
SMILES: O=C1C2=CC(OC)=C(OC)C=C2CC1CC3C=CN(CC=4C=CC=CC4)CC3
Tpsa: 38.77
Logp: 4.4847
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₂₇NO₃
Molecular Weight:
377.48
Synonyms:
None
SMILES:
O=C1C2=CC(OC)=C(OC)C=C2CC1CC3C=CN(CC=4C=CC=CC4)CC3
Tpsa:
38.77
Logp:
4.4847
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
6