AE99443
18706-39-3 | 2-(Trifluoromethyl)quinoline-4-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AE99443
ChemicalName
2-(Trifluoromethyl)quinoline-4-carboxylic acid
CasNumber
18706-39-3
MolecularFormula
C11H6F3NO2
MolecularWeight
241.166
MdlNumber
MFCD00835356
Smiles
OC(=O)c1cc(nc2c1cccc2)C(F)(F)F
Complexity
306
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.6
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CatalogNumber: AE99443
ChemicalName: 2-(Trifluoromethyl)quinoline-4-carboxylic acid
CasNumber: 18706-39-3
MolecularFormula: C11H6F3NO2
MolecularWeight: 241.166
MdlNumber: MFCD00835356
Smiles: OC(=O)c1cc(nc2c1cccc2)C(F)(F)F
Complexity: 306
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.6
CatalogNumber:
AE99443
ChemicalName:
2-(Trifluoromethyl)quinoline-4-carboxylic acid
CasNumber:
18706-39-3
MolecularFormula:
C11H6F3NO2
MolecularWeight:
241.166
MdlNumber:
MFCD00835356
Smiles:
OC(=O)c1cc(nc2c1cccc2)C(F)(F)F
Complexity:
306
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.6
CatalogNumber: __
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MolecularFormula: __
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Smiles: OCc1nc2c([nH]1)ncc(c2)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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MolecularFormula:
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Smiles:
OCc1nc2c([nH]1)ncc(c2)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
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MolecularFormula: __
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Smiles: NC(=N)NCC(=O)O.Cl
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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Xlogp3: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
NC(=N)NCC(=O)O.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
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Smiles: ClC(=O)c1ccccc1C(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ClC(=O)c1ccccc1C(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__