AD80851
10441-48-2 | (2-Methoxy-1-naphthyl)acetic acid
Manufacturer: A2B Chem
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CatalogNumber
AD80851
ChemicalName
(2-Methoxy-1-naphthyl)acetic acid
CasNumber
10441-48-2
MolecularFormula
C13H12O3
MolecularWeight
216.2326
MdlNumber
MFCD02664791
Smiles
COc1ccc2c(c1CC(=O)O)cccc2
Complexity
252
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.6
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CatalogNumber: AD80851
ChemicalName: (2-Methoxy-1-naphthyl)acetic acid
CasNumber: 10441-48-2
MolecularFormula: C13H12O3
MolecularWeight: 216.2326
MdlNumber: MFCD02664791
Smiles: COc1ccc2c(c1CC(=O)O)cccc2
Complexity: 252
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.6
CatalogNumber:
AD80851
ChemicalName:
(2-Methoxy-1-naphthyl)acetic acid
CasNumber:
10441-48-2
MolecularFormula:
C13H12O3
MolecularWeight:
216.2326
MdlNumber:
MFCD02664791
Smiles:
COc1ccc2c(c1CC(=O)O)cccc2
Complexity:
252
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.6
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Smiles: NC(=N)NC(=N)Nc1cccc(c1)[N+](=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
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Xlogp3: __
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Smiles:
NC(=N)NC(=N)Nc1cccc(c1)[N+](=O)[O-]
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: OC[C@H]1O[C@H](C(=C)[C@@H]1O)n1cnc2c1ncnc2N
Complexity: __
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Smiles:
OC[C@H]1O[C@H](C(=C)[C@@H]1O)n1cnc2c1ncnc2N
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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RotatableBondCount:
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Smiles: CCCCCCN1CCN(CC1)c1ccccc1
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Smiles:
CCCCCCN1CCN(CC1)c1ccccc1
Complexity:
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Covalently-bondedUnitCount:
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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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