CS-0806842
4-(Trifluoromethyl)-2-(3-(trifluoromethyl)phenyl)nicotinic acid
Manufacturer: ChemScene
CAS Number: 1261495-63-9
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Purity
98%
MDL No
MFCD18422649
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₄H₇F₆NO₂
Molecular Weight
335.20
Synonyms
None
SMILES
O=C(O)C1=C(C2=CC=CC(C(F)(F)F)=C2)N=CC=C1C(F)(F)F
Tpsa
50.19
Logp
4.4844
H Acceptors
2
H Donors
1
Rotatable Bonds
2
Related Products
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: MFCD18422649
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₇F₆NO₂
Molecular Weight: 335.20
Synonyms: None
SMILES: O=C(O)C1=C(C2=CC=CC(C(F)(F)F)=C2)N=CC=C1C(F)(F)F
Tpsa: 50.19
Logp: 4.4844
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD18422649
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₇F₆NO₂
Molecular Weight:
335.20
Synonyms:
None
SMILES:
O=C(O)C1=C(C2=CC=CC(C(F)(F)F)=C2)N=CC=C1C(F)(F)F
Tpsa:
50.19
Logp:
4.4844
H Acceptors:
2
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: C₅H₅BN₂O₂
Molecular Weight: 135.92
Synonyms: None
SMILES: B(C1=CNC(=C1)C#N)(O)O
Tpsa: 80.04
Logp: -1.43382
H Acceptors: 3
H Donors: 3
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:
C₅H₅BN₂O₂
Molecular Weight:
135.92
Synonyms:
None
SMILES:
B(C1=CNC(=C1)C#N)(O)O
Tpsa:
80.04
Logp:
-1.43382
H Acceptors:
3
H Donors:
3
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: C₁₀H₁₅BO₃S
Molecular Weight: 226.10
Synonyms: None
SMILES: COCCSCC1=CC=C(B(O)O)C=C1
Tpsa: 49.69
Logp: 0.246
H Acceptors: 4
H Donors: 2
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:
C₁₀H₁₅BO₃S
Molecular Weight:
226.10
Synonyms:
None
SMILES:
COCCSCC1=CC=C(B(O)O)C=C1
Tpsa:
49.69
Logp:
0.246
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
6
Purity: 98%
MDL No: MFCD18410895
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₈ClF₂NO₂
Molecular Weight: 283.66
Synonyms: None
SMILES: C1=CC(=C(C=C1OC(F)F)Cl)C(=O)C2=CC=NC=C2
Tpsa: 39.19
Logp: 3.5674
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 4
Purity:
98%
MDL No:
MFCD18410895
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₈ClF₂NO₂
Molecular Weight:
283.66
Synonyms:
None
SMILES:
C1=CC(=C(C=C1OC(F)F)Cl)C(=O)C2=CC=NC=C2
Tpsa:
39.19
Logp:
3.5674
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
4