AA75457
15014-25-2 | Dibenzyl malonate
Manufacturer: A2B Chem
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CatalogNumber
AA75457
ChemicalName
Dibenzyl malonate
CasNumber
15014-25-2
MolecularFormula
C17H16O4
MolecularWeight
284.3065
MdlNumber
MFCD00004779
Smiles
O=C(CC(=O)OCc1ccccc1)OCc1ccccc1
NscNumber
101027
Complexity
296
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
4
RotatableBondCount
8
Xlogp3
3.1
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CatalogNumber: AA75457
ChemicalName: Dibenzyl malonate
CasNumber: 15014-25-2
MolecularFormula: C17H16O4
MolecularWeight: 284.3065
MdlNumber: MFCD00004779
Smiles: O=C(CC(=O)OCc1ccccc1)OCc1ccccc1
NscNumber: 101027
Complexity: 296
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 4
RotatableBondCount: 8
Xlogp3: 3.1
CatalogNumber:
AA75457
ChemicalName:
Dibenzyl malonate
CasNumber:
15014-25-2
MolecularFormula:
C17H16O4
MolecularWeight:
284.3065
MdlNumber:
MFCD00004779
Smiles:
O=C(CC(=O)OCc1ccccc1)OCc1ccccc1
NscNumber:
101027
Complexity:
296
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
4
RotatableBondCount:
8
Xlogp3:
3.1
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Smiles: O=C(Oc1ccc(cc1)Cl)CC(=O)Oc1ccc(cc1)Cl
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Complexity: __
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HydrogenBondAcceptorCount: __
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Smiles:
O=C(Oc1ccc(cc1)Cl)CC(=O)Oc1ccc(cc1)Cl
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Complexity:
__
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Smiles: O=S1(=O)CCC2(CC1)CNC2.O=S1(=O)CCC2(CC1)CNC2.OC(=O)C(=O)O
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__
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Smiles:
O=S1(=O)CCC2(CC1)CNC2.O=S1(=O)CCC2(CC1)CNC2.OC(=O)C(=O)O
NscNumber:
__
Complexity:
__
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: OC(=O)c1nc(c(s1)Br)CC1CCCCC1
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HeavyAtomCount: __
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CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
OC(=O)c1nc(c(s1)Br)CC1CCCCC1
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__