AA93920
175204-90-7 | 6-(2,2,2-Trifluoroethoxy)nicotinic acid
Manufacturer: A2B Chem
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CatalogNumber
AA93920
ChemicalName
6-(2,2,2-Trifluoroethoxy)nicotinic acid
CasNumber
175204-90-7
MolecularFormula
C8H6F3NO3
MolecularWeight
221.1333
MdlNumber
MFCD00110708
Smiles
OC(=O)c1ccc(nc1)OCC(F)(F)F
Complexity
232
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1.8
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CatalogNumber: AA93920
ChemicalName: 6-(2,2,2-Trifluoroethoxy)nicotinic acid
CasNumber: 175204-90-7
MolecularFormula: C8H6F3NO3
MolecularWeight: 221.1333
MdlNumber: MFCD00110708
Smiles: OC(=O)c1ccc(nc1)OCC(F)(F)F
Complexity: 232
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.8
CatalogNumber:
AA93920
ChemicalName:
6-(2,2,2-Trifluoroethoxy)nicotinic acid
CasNumber:
175204-90-7
MolecularFormula:
C8H6F3NO3
MolecularWeight:
221.1333
MdlNumber:
MFCD00110708
Smiles:
OC(=O)c1ccc(nc1)OCC(F)(F)F
Complexity:
232
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1cc(ccc1O)OC(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1cc(ccc1O)OC(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA93922
ChemicalName: 2-(4-Trifluoromethyl-phenyl)-thiazole-4-carboxylic acid ethyl ester
CasNumber: 175204-88-3
MolecularFormula: C13H10F3NO2S
MolecularWeight: 301.2842
MdlNumber: MFCD00179674
Smiles: CCOC(=O)c1csc(n1)c1ccc(cc1)C(F)(F)F
Complexity: 343
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: __
RotatableBondCount: 4
Xlogp3: 4.1
CatalogNumber:
AA93922
ChemicalName:
2-(4-Trifluoromethyl-phenyl)-thiazole-4-carboxylic acid ethyl ester
CasNumber:
175204-88-3
MolecularFormula:
C13H10F3NO2S
MolecularWeight:
301.2842
MdlNumber:
MFCD00179674
Smiles:
CCOC(=O)c1csc(n1)c1ccc(cc1)C(F)(F)F
Complexity:
343
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
__
RotatableBondCount:
4
Xlogp3:
4.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ncc(c(c1)C(F)(F)F)C(=O)N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ncc(c(c1)C(F)(F)F)C(=O)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__