CS-1001815
Empagliflozin Impurity 66
Manufacturer: ChemScene
CAS Number: 1620758-30-6
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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
C₂₃H₂₇ClO₈
Molecular Weight
466.91
Synonyms
None
SMILES
C(C1=CC(C([C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)=O)=CC=C1Cl)C2=CC=C(O[C@H]3CCOC3)C=C2
Tpsa
136.68
Logp
0.7171
H Acceptors
8
H Donors
5
Rotatable Bonds
10
Related Products
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: C₂₃H₂₇ClO₈
Molecular Weight: 466.91
Synonyms: None
SMILES: C(C1=CC(C([C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)=O)=CC=C1Cl)C2=CC=C(O[C@H]3CCOC3)C=C2
Tpsa: 136.68
Logp: 0.7171
H Acceptors: 8
H Donors: 5
Rotatable Bonds: 10
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₃H₂₇ClO₈
Molecular Weight:
466.91
Synonyms:
None
SMILES:
C(C1=CC(C([C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)=O)=CC=C1Cl)C2=CC=C(O[C@H]3CCOC3)C=C2
Tpsa:
136.68
Logp:
0.7171
H Acceptors:
8
H Donors:
5
Rotatable Bonds:
10
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₁₆ClF₃N₄O₄
Molecular Weight: 468.81
Synonyms: None
SMILES: O=C(OCC)C1=CN(C2=NC(N)=C(F)C=C2F)C3=C(Cl)C(=C(F)C=C3C1=O)N4CC(O)C4
Tpsa: 110.68
Logp: 2.3962
H Acceptors: 8
H Donors: 2
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:
C₂₀H₁₆ClF₃N₄O₄
Molecular Weight:
468.81
Synonyms:
None
SMILES:
O=C(OCC)C1=CN(C2=NC(N)=C(F)C=C2F)C3=C(Cl)C(=C(F)C=C3C1=O)N4CC(O)C4
Tpsa:
110.68
Logp:
2.3962
H Acceptors:
8
H Donors:
2
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: C₅H₈ClNO₂
Molecular Weight: 149.58
Synonyms: None
SMILES: C(O)(=O)[C@@H]1C[C@@H](Cl)CN1
Tpsa: 49.33
Logp: 0.0403
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₈ClNO₂
Molecular Weight:
149.58
Synonyms:
None
SMILES:
C(O)(=O)[C@@H]1C[C@@H](Cl)CN1
Tpsa:
49.33
Logp:
0.0403
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
1
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₁₀N₄
Molecular Weight: 138.17
Synonyms: None
SMILES: [C@H]1(CCNC1)C=2NC=NN2
Tpsa: 53.6
Logp: -0.1184
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₁₀N₄
Molecular Weight:
138.17
Synonyms:
None
SMILES:
[C@H]1(CCNC1)C=2NC=NN2
Tpsa:
53.6
Logp:
-0.1184
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
1