AF82695
3147-58-8 | 1,3-Dihydroxy-2-naphthoic acid
Manufacturer: A2B Chem
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CatalogNumber
AF82695
ChemicalName
1,3-Dihydroxy-2-naphthoic acid
CasNumber
3147-58-8
MolecularFormula
C11H8O4
MolecularWeight
204.1788
MdlNumber
MFCD00458198
Smiles
OC(=O)c1c(O)cc2c(c1O)cccc2
Complexity
253
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
3
RotatableBondCount
1
Xlogp3
2.6
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CatalogNumber: AF82695
ChemicalName: 1,3-Dihydroxy-2-naphthoic acid
CasNumber: 3147-58-8
MolecularFormula: C11H8O4
MolecularWeight: 204.1788
MdlNumber: MFCD00458198
Smiles: OC(=O)c1c(O)cc2c(c1O)cccc2
Complexity: 253
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 1
Xlogp3: 2.6
CatalogNumber:
AF82695
ChemicalName:
1,3-Dihydroxy-2-naphthoic acid
CasNumber:
3147-58-8
MolecularFormula:
C11H8O4
MolecularWeight:
204.1788
MdlNumber:
MFCD00458198
Smiles:
OC(=O)c1c(O)cc2c(c1O)cccc2
Complexity:
253
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
1
Xlogp3:
2.6
CatalogNumber: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: CCC1C(O1)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
CCC1C(O1)C
Complexity:
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HydrogenBondDonorCount:
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RotatableBondCount:
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ChemicalName: __
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Smiles: O[C@H]([C@H](C(=O)O)O)C(=O)O.[Fe]
Complexity: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
O[C@H]([C@H](C(=O)O)O)C(=O)O.[Fe]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
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MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC1=CC(=CC(=C1O)OC)N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC1=CC(=CC(=C1O)OC)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__