AI64889
959-33-1 | 4-Methoxychalcone
Manufacturer: A2B Chem
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CatalogNumber
AI64889
ChemicalName
4-Methoxychalcone
CasNumber
959-33-1
MolecularFormula
C16H14O2
MolecularWeight
238.2812
MdlNumber
MFCD00017179
Smiles
COc1ccc(cc1)/C=C/C(=O)c1ccccc1
Complexity
282
Covalently-bondedUnitCount
1
DefinedBondStereocenterCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
2
RotatableBondCount
4
Xlogp3
3.1
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CatalogNumber: AI64889
ChemicalName: 4-Methoxychalcone
CasNumber: 959-33-1
MolecularFormula: C16H14O2
MolecularWeight: 238.2812
MdlNumber: MFCD00017179
Smiles: COc1ccc(cc1)/C=C/C(=O)c1ccccc1
Complexity: 282
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 2
RotatableBondCount: 4
Xlogp3: 3.1
CatalogNumber:
AI64889
ChemicalName:
4-Methoxychalcone
CasNumber:
959-33-1
MolecularFormula:
C16H14O2
MolecularWeight:
238.2812
MdlNumber:
MFCD00017179
Smiles:
COc1ccc(cc1)/C=C/C(=O)c1ccccc1
Complexity:
282
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
2
RotatableBondCount:
4
Xlogp3:
3.1
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MolecularFormula: __
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Smiles: OC(=O)c1ccn2c(c1)nc(c2)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
OC(=O)c1ccn2c(c1)nc(c2)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
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DefinedBondStereocenterCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: CCCCCCCC[N+](Cc1ccccc1)(C)C.[Cl-]
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Smiles:
CCCCCCCC[N+](Cc1ccccc1)(C)C.[Cl-]
Complexity:
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DefinedBondStereocenterCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: NCc1ncc(s1)c1ccccc1
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HeavyAtomCount: __
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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:
NCc1ncc(s1)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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