CS-1098327
4-Cyano-2-(trifluoromethyl)nicotinic acid
Manufacturer: ChemScene
CAS Number: 1806350-21-9
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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
C₈H₃F₃N₂O₂
Molecular Weight
216.12
Synonyms
None
SMILES
O=C(C1=C(C#N)C=CN=C1C(F)(F)F)O
Tpsa
73.98
Logp
1.67028
H Acceptors
3
H Donors
1
Rotatable Bonds
1
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: C₈H₃F₃N₂O₂
Molecular Weight: 216.12
Synonyms: None
SMILES: O=C(C1=C(C#N)C=CN=C1C(F)(F)F)O
Tpsa: 73.98
Logp: 1.67028
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:
C₈H₃F₃N₂O₂
Molecular Weight:
216.12
Synonyms:
None
SMILES:
O=C(C1=C(C#N)C=CN=C1C(F)(F)F)O
Tpsa:
73.98
Logp:
1.67028
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: C₁₀H₇ClN₂O₃
Molecular Weight: 238.63
Synonyms: None
SMILES: O=[N+](C1=C(Cl)C2=CC=CC(OC)=C2N=C1)[O-]
Tpsa: 65.26
Logp: 2.805
H Acceptors: 4
H Donors: 0
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:
C₁₀H₇ClN₂O₃
Molecular Weight:
238.63
Synonyms:
None
SMILES:
O=[N+](C1=C(Cl)C2=CC=CC(OC)=C2N=C1)[O-]
Tpsa:
65.26
Logp:
2.805
H Acceptors:
4
H Donors:
0
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: C₄H₅FN₂O
Molecular Weight: 116.09
Synonyms: None
SMILES: NC1=CC(CF)=NO1
Tpsa: 52.05
Logp: 0.7263
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:
C₄H₅FN₂O
Molecular Weight:
116.09
Synonyms:
None
SMILES:
NC1=CC(CF)=NO1
Tpsa:
52.05
Logp:
0.7263
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: C₉H₈BrIO₂
Molecular Weight: 354.97
Synonyms: None
SMILES: O=C(OC)C1=CC(C)=C(Br)C(I)=C1
Tpsa: 26.3
Logp: 3.14872
H Acceptors: 2
H Donors: 0
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:
C₉H₈BrIO₂
Molecular Weight:
354.97
Synonyms:
None
SMILES:
O=C(OC)C1=CC(C)=C(Br)C(I)=C1
Tpsa:
26.3
Logp:
3.14872
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1