CS-1002178
Pregabalin Impurity 79
Manufacturer: ChemScene
CAS Number: 181289-17-8
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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
C₁₀H₁₇NO₂
Molecular Weight
183.25
Synonyms
None
SMILES
N#CC(CC(=O)OCC)CC(C)C
Tpsa
50.09
Logp
2.12548
H Acceptors
3
H Donors
0
Rotatable Bonds
5
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: C₁₀H₁₇NO₂
Molecular Weight: 183.25
Synonyms: None
SMILES: N#CC(CC(=O)OCC)CC(C)C
Tpsa: 50.09
Logp: 2.12548
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₇NO₂
Molecular Weight:
183.25
Synonyms:
None
SMILES:
N#CC(CC(=O)OCC)CC(C)C
Tpsa:
50.09
Logp:
2.12548
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₇NO₂
Molecular Weight: 183.25
Synonyms: None
SMILES: [C@@H](CC(OCC)=O)(CC(C)C)C#N
Tpsa: 50.09
Logp: 2.12548
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₇NO₂
Molecular Weight:
183.25
Synonyms:
None
SMILES:
[C@@H](CC(OCC)=O)(CC(C)C)C#N
Tpsa:
50.09
Logp:
2.12548
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₁₃NO₂
Molecular Weight: 275.30
Synonyms: None
SMILES: O=C1C=CC(C=C1)=C(C2=NC=CC=C2)C3=CC=C(O)C=C3
Tpsa: 50.19
Logp: 3.2842
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₁₃NO₂
Molecular Weight:
275.30
Synonyms:
None
SMILES:
O=C1C=CC(C=C1)=C(C2=NC=CC=C2)C3=CC=C(O)C=C3
Tpsa:
50.19
Logp:
3.2842
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₃₁FO₁₁P₂
Molecular Weight: 552.42
Synonyms: None
SMILES: C[C@@]12[C@]([C@]3([C@](F)([C@@H](O)C1)[C@]4(C)C(CC3)=CC(=O)C=C4)[H])(C[C@@H](C)[C@@]2(C(COP(OP(=O)(O)O)(=O)O)=O)O)[H]
Tpsa: 187.89
Logp: 2.1297
H Acceptors: 8
H Donors: 5
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:
C₂₂H₃₁FO₁₁P₂
Molecular Weight:
552.42
Synonyms:
None
SMILES:
C[C@@]12[C@]([C@]3([C@](F)([C@@H](O)C1)[C@]4(C)C(CC3)=CC(=O)C=C4)[H])(C[C@@H](C)[C@@]2(C(COP(OP(=O)(O)O)(=O)O)=O)O)[H]
Tpsa:
187.89
Logp:
2.1297
H Acceptors:
8
H Donors:
5
Rotatable Bonds:
6