AH94327
926255-89-2 | 5-(3,4-Dichlorophenyl)nicotinic acid
Manufacturer: A2B Chem
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CatalogNumber
AH94327
ChemicalName
5-(3,4-Dichlorophenyl)nicotinic acid
CasNumber
926255-89-2
MolecularFormula
C12H7Cl2NO2
MolecularWeight
268.0955
MdlNumber
MFCD09042512
Smiles
OC(=O)c1cncc(c1)c1ccc(c(c1)Cl)Cl
Complexity
288
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
3.3
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CatalogNumber: AH94327
ChemicalName: 5-(3,4-Dichlorophenyl)nicotinic acid
CasNumber: 926255-89-2
MolecularFormula: C12H7Cl2NO2
MolecularWeight: 268.0955
MdlNumber: MFCD09042512
Smiles: OC(=O)c1cncc(c1)c1ccc(c(c1)Cl)Cl
Complexity: 288
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 3.3
CatalogNumber:
AH94327
ChemicalName:
5-(3,4-Dichlorophenyl)nicotinic acid
CasNumber:
926255-89-2
MolecularFormula:
C12H7Cl2NO2
MolecularWeight:
268.0955
MdlNumber:
MFCD09042512
Smiles:
OC(=O)c1cncc(c1)c1ccc(c(c1)Cl)Cl
Complexity:
288
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
3.3
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MolecularFormula: __
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Smiles: C1=CC(=CC(=C1)C2=NC=C(C=C2)C(=O)O)C3=NC=C(C=C3)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
C1=CC(=CC(=C1)C2=NC=C(C=C2)C(=O)O)C3=NC=C(C=C3)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
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MdlNumber: __
Smiles: COc1ccc(cc1)c1nccc(c1)C(=O)O
Complexity: 261
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.3
CatalogNumber:
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ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
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MdlNumber:
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Smiles:
COc1ccc(cc1)c1nccc(c1)C(=O)O
Complexity:
261
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.3
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MolecularFormula: __
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MdlNumber: __
Smiles: OC(=O)c1ccc(o1)c1cccs1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1ccc(o1)c1cccs1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__