AI48656
35225-79-7 | Dibenzylideneacetone
Manufacturer: A2B Chem
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CatalogNumber
AI48656
ChemicalName
Dibenzylideneacetone
CasNumber
35225-79-7
MolecularFormula
C17H14O
MolecularWeight
234.2925
MdlNumber
MFCD00004790
Smiles
O=C(C=Cc1ccccc1)C=Cc1ccccc1
NscNumber
623642
Complexity
272
Covalently-bondedUnitCount
1
DefinedBondStereocenterCount
2
HeavyAtomCount
18
HydrogenBondAcceptorCount
1
RotatableBondCount
4
Xlogp3
4.1
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CatalogNumber: AI48656
ChemicalName: Dibenzylideneacetone
CasNumber: 35225-79-7
MolecularFormula: C17H14O
MolecularWeight: 234.2925
MdlNumber: MFCD00004790
Smiles: O=C(C=Cc1ccccc1)C=Cc1ccccc1
NscNumber: 623642
Complexity: 272
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: 2
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 1
RotatableBondCount: 4
Xlogp3: 4.1
CatalogNumber:
AI48656
ChemicalName:
Dibenzylideneacetone
CasNumber:
35225-79-7
MolecularFormula:
C17H14O
MolecularWeight:
234.2925
MdlNumber:
MFCD00004790
Smiles:
O=C(C=Cc1ccccc1)C=Cc1ccccc1
NscNumber:
623642
Complexity:
272
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
2
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
1
RotatableBondCount:
4
Xlogp3:
4.1
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Smiles: COC(=O)[C@@H](CCCNC(=O)OCc1ccccc1)N
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Complexity: __
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Smiles:
COC(=O)[C@@H](CCCNC(=O)OCc1ccccc1)N
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Smiles: [N-]=[N+]=NCCSSCCN=[N+]=[N-]
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[N-]=[N+]=NCCSSCCN=[N+]=[N-]
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Smiles: CSc1nc2nc(Cl)ccc2cn1
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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:
CSc1nc2nc(Cl)ccc2cn1
NscNumber:
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Complexity:
__
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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