AD37344
36701-89-0 | 2-[3-(Trifluoromethyl)phenoxy]nicotinic acid
Manufacturer: A2B Chem
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CatalogNumber
AD37344
ChemicalName
2-[3-(Trifluoromethyl)phenoxy]nicotinic acid
CasNumber
36701-89-0
MolecularFormula
C13H8F3NO3
MolecularWeight
283.20272959999994
MdlNumber
MFCD01938784
Smiles
OC(=O)c1cccnc1Oc1cccc(c1)C(F)(F)F
Complexity
348
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
3.1
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CatalogNumber: AD37344
ChemicalName: 2-[3-(Trifluoromethyl)phenoxy]nicotinic acid
CasNumber: 36701-89-0
MolecularFormula: C13H8F3NO3
MolecularWeight: 283.20272959999994
MdlNumber: MFCD01938784
Smiles: OC(=O)c1cccnc1Oc1cccc(c1)C(F)(F)F
Complexity: 348
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 3.1
CatalogNumber:
AD37344
ChemicalName:
2-[3-(Trifluoromethyl)phenoxy]nicotinic acid
CasNumber:
36701-89-0
MolecularFormula:
C13H8F3NO3
MolecularWeight:
283.20272959999994
MdlNumber:
MFCD01938784
Smiles:
OC(=O)c1cccnc1Oc1cccc(c1)C(F)(F)F
Complexity:
348
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
3.1
CatalogNumber: __
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MolecularFormula: __
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Smiles: COc1cc(OC)ccc1C=CC(=O)c1ccccc1O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
COc1cc(OC)ccc1C=CC(=O)c1ccccc1O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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ChemicalName: __
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MolecularFormula: __
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Smiles: COc1cccc(c1)NC(=O)c1ccccc1I
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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:
COc1cccc(c1)NC(=O)c1ccccc1I
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1ccnc(n1)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1ccnc(n1)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__