AF56529
3470-46-0 | 5-Oxo-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AF56529
ChemicalName
5-Oxo-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid
CasNumber
3470-46-0
MolecularFormula
C11H10O3
MolecularWeight
190.1953
MdlNumber
MFCD01763813
Smiles
OC(=O)c1ccc2c(c1)CCCC2=O
Complexity
259
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.5
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CatalogNumber: AF56529
ChemicalName: 5-Oxo-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid
CasNumber: 3470-46-0
MolecularFormula: C11H10O3
MolecularWeight: 190.1953
MdlNumber: MFCD01763813
Smiles: OC(=O)c1ccc2c(c1)CCCC2=O
Complexity: 259
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.5
CatalogNumber:
AF56529
ChemicalName:
5-Oxo-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid
CasNumber:
3470-46-0
MolecularFormula:
C11H10O3
MolecularWeight:
190.1953
MdlNumber:
MFCD01763813
Smiles:
OC(=O)c1ccc2c(c1)CCCC2=O
Complexity:
259
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)Nc1ccc2c(c1)N(C(=O)CCN1CCOCC1)c1c(S2)cccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)Nc1ccc2c(c1)N(C(=O)CCN1CCOCC1)c1c(S2)cccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AF56531
ChemicalName: 1-(4-Nitrophenyl)-1h-pyrazole
CasNumber: 3463-30-7
MolecularFormula: C9H7N3O2
MolecularWeight: 189.1708
MdlNumber: MFCD00187828
Smiles: [O-][N+](=O)c1ccc(cc1)n1cccn1
Complexity: 209
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 2
CatalogNumber:
AF56531
ChemicalName:
1-(4-Nitrophenyl)-1h-pyrazole
CasNumber:
3463-30-7
MolecularFormula:
C9H7N3O2
MolecularWeight:
189.1708
MdlNumber:
MFCD00187828
Smiles:
[O-][N+](=O)c1ccc(cc1)n1cccn1
Complexity:
209
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__