CS-1003518
Pregabalin Impurity 129
Manufacturer: ChemScene
CAS Number: 3016-28-2
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Purity
97%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₇H₁₅NO
Molecular Weight
129.20
Synonyms
None
SMILES
O=C(N)CCCC(C)C
Tpsa
43.09
Logp
1.298
H Acceptors
1
H Donors
1
Rotatable Bonds
4
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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: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₅NO
Molecular Weight: 129.20
Synonyms: None
SMILES: O=C(N)CCCC(C)C
Tpsa: 43.09
Logp: 1.298
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 4
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₁₅NO
Molecular Weight:
129.20
Synonyms:
None
SMILES:
O=C(N)CCCC(C)C
Tpsa:
43.09
Logp:
1.298
H Acceptors:
1
H Donors:
1
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: C₃₁H₃₇N₅O₆S
Molecular Weight: 607.72
Synonyms: None
SMILES: O=S(=O)(NC=1N=C(N=C(OCCOC(C)(C)C)C1OC=2C=CC=CC2OC)C3=NC=CC=N3)C4=CC=C(C=C4)C(C)(C)C
Tpsa: 134.65
Logp: 6.0267
H Acceptors: 10
H Donors: 1
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:
C₃₁H₃₇N₅O₆S
Molecular Weight:
607.72
Synonyms:
None
SMILES:
O=S(=O)(NC=1N=C(N=C(OCCOC(C)(C)C)C1OC=2C=CC=CC2OC)C3=NC=CC=N3)C4=CC=C(C=C4)C(C)(C)C
Tpsa:
134.65
Logp:
6.0267
H Acceptors:
10
H Donors:
1
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: C₁₉H₁₇FO₄S
Molecular Weight: 360.40
Synonyms: None
SMILES: O=C1C(C2=CC=CC(F)=C2)=C(OC1(C)C)C=3C=CC(=CC3)S(=O)(=O)C
Tpsa: 60.44
Logp: 3.4754
H Acceptors: 4
H Donors: 0
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:
C₁₉H₁₇FO₄S
Molecular Weight:
360.40
Synonyms:
None
SMILES:
O=C1C(C2=CC=CC(F)=C2)=C(OC1(C)C)C=3C=CC(=CC3)S(=O)(=O)C
Tpsa:
60.44
Logp:
3.4754
H Acceptors:
4
H Donors:
0
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: C₁₈H₁₆FNO₄S
Molecular Weight: 361.39
Synonyms: None
SMILES: O=C1C(=C(OC1(C)C)C=2C=CC(=CC2)S(=O)(=O)N)C=3C=CC=CC3F
Tpsa: 86.46
Logp: 2.7193
H Acceptors: 4
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:
C₁₈H₁₆FNO₄S
Molecular Weight:
361.39
Synonyms:
None
SMILES:
O=C1C(=C(OC1(C)C)C=2C=CC(=CC2)S(=O)(=O)N)C=3C=CC=CC3F
Tpsa:
86.46
Logp:
2.7193
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3