AD68080
16726-67-3 | 5-Bromo-1-naphthoic acid
Manufacturer: A2B Chem
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CatalogNumber
AD68080
ChemicalName
5-Bromo-1-naphthoic acid
CasNumber
16726-67-3
MolecularFormula
C11H7BrO2
MolecularWeight
251.0761
MdlNumber
MFCD00092713
Smiles
OC(=O)c1cccc2c1cccc2Br
Complexity
229
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
3.8
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CatalogNumber: AD68080
ChemicalName: 5-Bromo-1-naphthoic acid
CasNumber: 16726-67-3
MolecularFormula: C11H7BrO2
MolecularWeight: 251.0761
MdlNumber: MFCD00092713
Smiles: OC(=O)c1cccc2c1cccc2Br
Complexity: 229
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 3.8
CatalogNumber:
AD68080
ChemicalName:
5-Bromo-1-naphthoic acid
CasNumber:
16726-67-3
MolecularFormula:
C11H7BrO2
MolecularWeight:
251.0761
MdlNumber:
MFCD00092713
Smiles:
OC(=O)c1cccc2c1cccc2Br
Complexity:
229
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
3.8
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Smiles: CNC(=O)C1(CCNCC1)c1ccccc1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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RotatableBondCount: __
Xlogp3: __
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Smiles:
CNC(=O)C1(CCNCC1)c1ccccc1
Complexity:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: N#CC1(CCN(CC1)C(=O)OC(C)(C)C)c1ccccn1
Complexity: __
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Smiles:
N#CC1(CCN(CC1)C(=O)OC(C)(C)C)c1ccccn1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: CC(=O)Nc1ccc(c(c1)C(=O)c1ccccc1O)OC(=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CC(=O)Nc1ccc(c(c1)C(=O)c1ccccc1O)OC(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__