AC20142
84659-98-3 | 6-Hydroxy-2-phenyl-pyrimidine-4-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AC20142
ChemicalName
6-Hydroxy-2-phenyl-pyrimidine-4-carboxylic acid
CasNumber
84659-98-3
MolecularFormula
C11H8N2O3
MolecularWeight
216.1928
MdlNumber
MFCD00856151
Smiles
O=c1cc([nH]c(n1)c1ccccc1)C(=O)O
Complexity
379
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
0.7
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CatalogNumber: AC20142
ChemicalName: 6-Hydroxy-2-phenyl-pyrimidine-4-carboxylic acid
CasNumber: 84659-98-3
MolecularFormula: C11H8N2O3
MolecularWeight: 216.1928
MdlNumber: MFCD00856151
Smiles: O=c1cc([nH]c(n1)c1ccccc1)C(=O)O
Complexity: 379
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 0.7
CatalogNumber:
AC20142
ChemicalName:
6-Hydroxy-2-phenyl-pyrimidine-4-carboxylic acid
CasNumber:
84659-98-3
MolecularFormula:
C11H8N2O3
MolecularWeight:
216.1928
MdlNumber:
MFCD00856151
Smiles:
O=c1cc([nH]c(n1)c1ccccc1)C(=O)O
Complexity:
379
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
0.7
CatalogNumber: AC20147
ChemicalName: Ethyl 5-chloro-4,6-dihydroxynicotinate
CasNumber: 846541-71-7
MolecularFormula: C8H8ClNO4
MolecularWeight: 217.6064
MdlNumber: MFCD00234417
Smiles: CCOC(=O)c1cnc(c(c1O)Cl)O
Complexity: 345
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: 0.9
CatalogNumber:
AC20147
ChemicalName:
Ethyl 5-chloro-4,6-dihydroxynicotinate
CasNumber:
846541-71-7
MolecularFormula:
C8H8ClNO4
MolecularWeight:
217.6064
MdlNumber:
MFCD00234417
Smiles:
CCOC(=O)c1cnc(c(c1O)Cl)O
Complexity:
345
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
0.9
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Smiles: Cc1ccc(cc1)C(=O)Nc1ccc2c(c1)cccc2
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Smiles:
Cc1ccc(cc1)C(=O)Nc1ccc2c(c1)cccc2
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Smiles: CCCc1ccccc1OP(=O)(Oc1ccccc1CCC)Oc1ccccc1CCC
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Smiles:
CCCc1ccccc1OP(=O)(Oc1ccccc1CCC)Oc1ccccc1CCC
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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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