CS-1005296
Pregabalin Impurity 193
Manufacturer: ChemScene
CAS Number: 91681-94-6
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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
C₁₂H₂₅NO₇
Molecular Weight
295.33
Synonyms
None
SMILES
[C@H](NC[C@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)(CC(C)C)C(O)=O
Tpsa
150.48
Logp
-2.4888
H Acceptors
7
H Donors
7
Rotatable Bonds
10
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: C₁₂H₂₅NO₇
Molecular Weight: 295.33
Synonyms: None
SMILES: [C@H](NC[C@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)(CC(C)C)C(O)=O
Tpsa: 150.48
Logp: -2.4888
H Acceptors: 7
H Donors: 7
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:
C₁₂H₂₅NO₇
Molecular Weight:
295.33
Synonyms:
None
SMILES:
[C@H](NC[C@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)(CC(C)C)C(O)=O
Tpsa:
150.48
Logp:
-2.4888
H Acceptors:
7
H Donors:
7
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: C₁₄H₁₆N₂O
Molecular Weight: 228.29
Synonyms: None
SMILES: OC1C=2C=CC=CC2CC1(C3=CN=CN3)CC
Tpsa: 48.91
Logp: 2.3472
H Acceptors: 2
H Donors: 2
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:
C₁₄H₁₆N₂O
Molecular Weight:
228.29
Synonyms:
None
SMILES:
OC1C=2C=CC=CC2CC1(C3=CN=CN3)CC
Tpsa:
48.91
Logp:
2.3472
H Acceptors:
2
H Donors:
2
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: C₂₆H₂₉NO₉
Molecular Weight: 499.51
Synonyms: None
SMILES: O([C@@H]1C2=C(C(O)=C3C(=C2O)C(=O)C=4C(C3=O)=CC=CC4)C[C@]([C@@H](C)O)(O)C1)[C@H]5C[C@H](N)[C@H](O)[C@H](C)O5
Tpsa: 179.77
Logp: 0.8121
H Acceptors: 10
H Donors: 6
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:
C₂₆H₂₉NO₉
Molecular Weight:
499.51
Synonyms:
None
SMILES:
O([C@@H]1C2=C(C(O)=C3C(=C2O)C(=O)C=4C(C3=O)=CC=CC4)C[C@]([C@@H](C)O)(O)C1)[C@H]5C[C@H](N)[C@H](O)[C@H](C)O5
Tpsa:
179.77
Logp:
0.8121
H Acceptors:
10
H Donors:
6
Rotatable Bonds:
3
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₀F₃N₃O
Molecular Weight: 269.22
Synonyms: None
SMILES: O=C(N)C=1C=C(C=C(C1)C(F)(F)F)N2C=NC(=C2)C
Tpsa: 60.91
Logp: 2.29842
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₀F₃N₃O
Molecular Weight:
269.22
Synonyms:
None
SMILES:
O=C(N)C=1C=C(C=C(C1)C(F)(F)F)N2C=NC(=C2)C
Tpsa:
60.91
Logp:
2.29842
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2