AH59264
7568-08-3 | 6-(Methoxycarbonyl)-2-naphthoic acid
Manufacturer: A2B Chem
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CatalogNumber
AH59264
ChemicalName
6-(Methoxycarbonyl)-2-naphthoic acid
CasNumber
7568-08-3
MolecularFormula
C13H10O4
MolecularWeight
230.2161
MdlNumber
MFCD00805122
Smiles
COC(=O)c1ccc2c(c1)ccc(c2)C(=O)O
Complexity
313
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.6
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CatalogNumber: AH59264
ChemicalName: 6-(Methoxycarbonyl)-2-naphthoic acid
CasNumber: 7568-08-3
MolecularFormula: C13H10O4
MolecularWeight: 230.2161
MdlNumber: MFCD00805122
Smiles: COC(=O)c1ccc2c(c1)ccc(c2)C(=O)O
Complexity: 313
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.6
CatalogNumber:
AH59264
ChemicalName:
6-(Methoxycarbonyl)-2-naphthoic acid
CasNumber:
7568-08-3
MolecularFormula:
C13H10O4
MolecularWeight:
230.2161
MdlNumber:
MFCD00805122
Smiles:
COC(=O)c1ccc2c(c1)ccc(c2)C(=O)O
Complexity:
313
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.6
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Smiles: OCCOC(=O)c1ccccc1C(=O)OCCO
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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RotatableBondCount: __
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Smiles:
OCCOC(=O)c1ccccc1C(=O)OCCO
Complexity:
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Smiles: COC(=O)/C(=N/Nc1ccccc1Cl)/Cl
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MolecularFormula:
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Smiles:
COC(=O)/C(=N/Nc1ccccc1Cl)/Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
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Smiles: COC(=N)CCCCl.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=N)CCCCl.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__