AB84685
89781-52-2 | 8-Oxo-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AB84685
ChemicalName
8-Oxo-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid
CasNumber
89781-52-2
MolecularFormula
C11H10O3
MolecularWeight
190.1953
MdlNumber
MFCD00471460
Smiles
O=C1CCCc2c1cc(cc2)C(=O)O
Complexity
259
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.5
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CatalogNumber: AB84685
ChemicalName: 8-Oxo-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid
CasNumber: 89781-52-2
MolecularFormula: C11H10O3
MolecularWeight: 190.1953
MdlNumber: MFCD00471460
Smiles: O=C1CCCc2c1cc(cc2)C(=O)O
Complexity: 259
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.5
CatalogNumber:
AB84685
ChemicalName:
8-Oxo-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid
CasNumber:
89781-52-2
MolecularFormula:
C11H10O3
MolecularWeight:
190.1953
MdlNumber:
MFCD00471460
Smiles:
O=C1CCCc2c1cc(cc2)C(=O)O
Complexity:
259
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
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Smiles: ClCCCC(=O)Nc1ccc2c(c1)OCO2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
ClCCCC(=O)Nc1ccc2c(c1)OCO2
Complexity:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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MolecularFormula: __
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Smiles: Nc1ccc(nc1C)S(=O)(=O)C
Complexity: __
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Smiles:
Nc1ccc(nc1C)S(=O)(=O)C
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Clc1ccc2c(c1)nncc2C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Clc1ccc2c(c1)nncc2C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__