AD95588
849757-80-8 | 4-(3-Methoxypyridin-2-yl)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AD95588
ChemicalName
4-(3-Methoxypyridin-2-yl)benzoic acid
CasNumber
849757-80-8
MolecularFormula
C13H11NO3
MolecularWeight
229.2313
MdlNumber
MFCD16877924
Smiles
COc1cccnc1c1ccc(cc1)C(=O)O
Complexity
261
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2
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CatalogNumber: AD95588
ChemicalName: 4-(3-Methoxypyridin-2-yl)benzoic acid
CasNumber: 849757-80-8
MolecularFormula: C13H11NO3
MolecularWeight: 229.2313
MdlNumber: MFCD16877924
Smiles: COc1cccnc1c1ccc(cc1)C(=O)O
Complexity: 261
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2
CatalogNumber:
AD95588
ChemicalName:
4-(3-Methoxypyridin-2-yl)benzoic acid
CasNumber:
849757-80-8
MolecularFormula:
C13H11NO3
MolecularWeight:
229.2313
MdlNumber:
MFCD16877924
Smiles:
COc1cccnc1c1ccc(cc1)C(=O)O
Complexity:
261
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: FC(c1ccc(cc1)NCC1CCCC1)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
FC(c1ccc(cc1)NCC1CCCC1)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
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Smiles: CCCCCCCCCc1cc(c(c(c1)C(c1ccccc1)(C)C)O)C(c1ccccc1)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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RotatableBondCount: __
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Smiles:
CCCCCCCCCc1cc(c(c(c1)C(c1ccccc1)(C)C)O)C(c1ccccc1)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: OCCOCCOCCOCCOB(OCCOCCOCCOCCO)OCCOCCOCCOCCO
Complexity: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
OCCOCCOCCOCCOB(OCCOCCOCCOCCO)OCCOCCOCCOCCO
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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