AD59517
1188265-06-6 | Ethyl 7-(4-methoxyphenyl)-4,7-dioxoheptanoate
Manufacturer: A2B Chem
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CatalogNumber
AD59517
ChemicalName
Ethyl 7-(4-methoxyphenyl)-4,7-dioxoheptanoate
CasNumber
1188265-06-6
MolecularFormula
C16H20O5
MolecularWeight
292.327
MdlNumber
MFCD13152310
Smiles
CCOC(=O)CCC(=O)CCC(=O)c1ccc(cc1)OC
Complexity
356
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
5
RotatableBondCount
10
Xlogp3
1.7
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CatalogNumber: AD59517
ChemicalName: Ethyl 7-(4-methoxyphenyl)-4,7-dioxoheptanoate
CasNumber: 1188265-06-6
MolecularFormula: C16H20O5
MolecularWeight: 292.327
MdlNumber: MFCD13152310
Smiles: CCOC(=O)CCC(=O)CCC(=O)c1ccc(cc1)OC
Complexity: 356
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 5
RotatableBondCount: 10
Xlogp3: 1.7
CatalogNumber:
AD59517
ChemicalName:
Ethyl 7-(4-methoxyphenyl)-4,7-dioxoheptanoate
CasNumber:
1188265-06-6
MolecularFormula:
C16H20O5
MolecularWeight:
292.327
MdlNumber:
MFCD13152310
Smiles:
CCOC(=O)CCC(=O)CCC(=O)c1ccc(cc1)OC
Complexity:
356
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
5
RotatableBondCount:
10
Xlogp3:
1.7
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Smiles: Cc1ccc(cc1)S(=O)(=O)NCCN1CCCC1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
Cc1ccc(cc1)S(=O)(=O)NCCN1CCCC1
Complexity:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: CC1CCN(CC1O)C(=O)OC(C)(C)C
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Smiles:
CC1CCN(CC1O)C(=O)OC(C)(C)C
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: N#Cc1cccc(c1)C(N)C.Cl
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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CatalogNumber:
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ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
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MdlNumber:
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Smiles:
N#Cc1cccc(c1)C(N)C.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__