AG05057
36651-36-2 | Ethyl 7-oxooctanoate
Manufacturer: A2B Chem
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CatalogNumber
AG05057
ChemicalName
Ethyl 7-oxooctanoate
CasNumber
36651-36-2
MolecularFormula
C10H18O3
MolecularWeight
186.24812000000003
MdlNumber
MFCD30470128
Smiles
CCOC(=O)CCCCCC(=O)C
NscNumber
141180
Complexity
164
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
RotatableBondCount
8
Xlogp3
1.3
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CatalogNumber: AG05057
ChemicalName: Ethyl 7-oxooctanoate
CasNumber: 36651-36-2
MolecularFormula: C10H18O3
MolecularWeight: 186.24812000000003
MdlNumber: MFCD30470128
Smiles: CCOC(=O)CCCCCC(=O)C
NscNumber: 141180
Complexity: 164
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
RotatableBondCount: 8
Xlogp3: 1.3
CatalogNumber:
AG05057
ChemicalName:
Ethyl 7-oxooctanoate
CasNumber:
36651-36-2
MolecularFormula:
C10H18O3
MolecularWeight:
186.24812000000003
MdlNumber:
MFCD30470128
Smiles:
CCOC(=O)CCCCCC(=O)C
NscNumber:
141180
Complexity:
164
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
RotatableBondCount:
8
Xlogp3:
1.3
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Smiles: CC(C)NCCC(C1=CC=CC=C1)(C2=CC=CC=N2)C(=O)N
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CC(C)NCCC(C1=CC=CC=C1)(C2=CC=CC=N2)C(=O)N
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
__
Xlogp3:
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Smiles: CCOC(CSC(C)C)OCC
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HydrogenBondAcceptorCount: __
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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:
CCOC(CSC(C)C)OCC
NscNumber:
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Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
__
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Smiles: CC(=C)c1cccc(c1)C(F)(F)F
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=C)c1cccc(c1)C(F)(F)F
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__