CS-1094772
1-Isobutyl-2-oxo-5-(3-(trifluoromethyl)phenyl)-1,2-dihydropyridine-3-carbonitrile
Manufacturer: ChemScene
CAS Number: 338964-50-4
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Purity
90%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₇H₁₅F₃N₂O
Molecular Weight
320.31
Synonyms
None
SMILES
N#CC1=CC(=CN(C1=O)CC(C)C)C=2C=CC=C(C2)C(F)(F)F
Tpsa
45.79
Logp
4.06178
H Acceptors
3
H Donors
0
Rotatable Bonds
3
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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: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₁₅F₃N₂O
Molecular Weight: 320.31
Synonyms: None
SMILES: N#CC1=CC(=CN(C1=O)CC(C)C)C=2C=CC=C(C2)C(F)(F)F
Tpsa: 45.79
Logp: 4.06178
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 3
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₁₅F₃N₂O
Molecular Weight:
320.31
Synonyms:
None
SMILES:
N#CC1=CC(=CN(C1=O)CC(C)C)C=2C=CC=C(C2)C(F)(F)F
Tpsa:
45.79
Logp:
4.06178
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3
Purity: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₁F₃N₂O
Molecular Weight: 304.27
Synonyms: None
SMILES: N#CC1=CC(=CN(C1=O)CC=C)C=2C=CC=C(C2)C(F)(F)F
Tpsa: 45.79
Logp: 3.59178
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 3
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₁F₃N₂O
Molecular Weight:
304.27
Synonyms:
None
SMILES:
N#CC1=CC(=CN(C1=O)CC=C)C=2C=CC=C(C2)C(F)(F)F
Tpsa:
45.79
Logp:
3.59178
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3
Purity: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₂ClNO₃S
Molecular Weight: 297.76
Synonyms: None
SMILES: O=C1NC(=CC(=C1S(=O)(=O)C=2C=CC=C(Cl)C2)C)C
Tpsa: 67
Logp: 2.47794
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₂ClNO₃S
Molecular Weight:
297.76
Synonyms:
None
SMILES:
O=C1NC(=CC(=C1S(=O)(=O)C=2C=CC=C(Cl)C2)C)C
Tpsa:
67
Logp:
2.47794
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₂ClNO₃S
Molecular Weight: 297.76
Synonyms: None
SMILES: O=C1NC(=CC(=C1S(=O)(=O)C=2C=CC=CC2Cl)C)C
Tpsa: 67
Logp: 2.47794
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₂ClNO₃S
Molecular Weight:
297.76
Synonyms:
None
SMILES:
O=C1NC(=CC(=C1S(=O)(=O)C=2C=CC=CC2Cl)C)C
Tpsa:
67
Logp:
2.47794
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2