CS-0815817
1-(Tert-butyl)-6,7,8-trifluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
Manufacturer: ChemScene
CAS Number: 150805-04-2
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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
C₁₄H₁₂F₃NO₃
Molecular Weight
299.25
Synonyms
None
SMILES
O=C1C(C(O)=O)=CN(C(C)(C)C)C2=C(F)C(F)=C(F)C=C21
Tpsa
59.3
Logp
2.872
H Acceptors
3
H Donors
1
Rotatable Bonds
1
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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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₂F₃NO₃
Molecular Weight: 299.25
Synonyms: None
SMILES: O=C1C(C(O)=O)=CN(C(C)(C)C)C2=C(F)C(F)=C(F)C=C21
Tpsa: 59.3
Logp: 2.872
H Acceptors: 3
H Donors: 1
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:
C₁₄H₁₂F₃NO₃
Molecular Weight:
299.25
Synonyms:
None
SMILES:
O=C1C(C(O)=O)=CN(C(C)(C)C)C2=C(F)C(F)=C(F)C=C21
Tpsa:
59.3
Logp:
2.872
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₆ClNO₅
Molecular Weight: 289.71
Synonyms: None
SMILES: OC1=C(C(OCC)=O)C(C(OCC)=O)=CN=C1C.Cl
Tpsa: 85.72
Logp: 1.87082
H Acceptors: 6
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:
C₁₂H₁₆ClNO₅
Molecular Weight:
289.71
Synonyms:
None
SMILES:
OC1=C(C(OCC)=O)C(C(OCC)=O)=CN=C1C.Cl
Tpsa:
85.72
Logp:
1.87082
H Acceptors:
6
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: C₁₄H₁₂ClNO₃
Molecular Weight: 277.70
Synonyms: None
SMILES: O=C1C(C(O)=O)=CN(C2CC2)C3=C(C)C(Cl)=CC=C31
Tpsa: 59.3
Logp: 2.99642
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₂ClNO₃
Molecular Weight:
277.70
Synonyms:
None
SMILES:
O=C1C(C(O)=O)=CN(C2CC2)C3=C(C)C(Cl)=CC=C31
Tpsa:
59.3
Logp:
2.99642
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: C₁₅H₁₈FN₃O₂
Molecular Weight: 291.32
Synonyms: None
SMILES: NC1=NC(C2=CC=C(F)C=C2)=C(C(OC)=O)C(C(C)C)N1
Tpsa: 76.71
Logp: 1.6523
H Acceptors: 5
H Donors: 2
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:
C₁₅H₁₈FN₃O₂
Molecular Weight:
291.32
Synonyms:
None
SMILES:
NC1=NC(C2=CC=C(F)C=C2)=C(C(OC)=O)C(C(C)C)N1
Tpsa:
76.71
Logp:
1.6523
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
3