AD27675
22027-51-6 | Methyl 3-(4-methylphenyl)-3-oxopropanoate
Manufacturer: A2B Chem
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CatalogNumber
AD27675
ChemicalName
Methyl 3-(4-methylphenyl)-3-oxopropanoate
CasNumber
22027-51-6
MolecularFormula
C11H12O3
MolecularWeight
192.2112
MdlNumber
MFCD03424778
Smiles
COC(=O)CC(=O)c1ccc(cc1)C
NscNumber
157310
Complexity
215
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
RotatableBondCount
4
Xlogp3
2
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CatalogNumber: AD27675
ChemicalName: Methyl 3-(4-methylphenyl)-3-oxopropanoate
CasNumber: 22027-51-6
MolecularFormula: C11H12O3
MolecularWeight: 192.2112
MdlNumber: MFCD03424778
Smiles: COC(=O)CC(=O)c1ccc(cc1)C
NscNumber: 157310
Complexity: 215
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
RotatableBondCount: 4
Xlogp3: 2
CatalogNumber:
AD27675
ChemicalName:
Methyl 3-(4-methylphenyl)-3-oxopropanoate
CasNumber:
22027-51-6
MolecularFormula:
C11H12O3
MolecularWeight:
192.2112
MdlNumber:
MFCD03424778
Smiles:
COC(=O)CC(=O)c1ccc(cc1)C
NscNumber:
157310
Complexity:
215
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
RotatableBondCount:
4
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)CC(=O)c1ccc(cc1)OC
NscNumber: __
Complexity: 229
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
COC(=O)CC(=O)c1ccc(cc1)OC
NscNumber:
__
Complexity:
229
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.6
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)Nc1ccc(cc1C#N)Br
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CCOC(=O)Nc1ccc(cc1C#N)Br
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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MolecularWeight: __
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Smiles: FC(c1ccc2c(c1)CNCC2)(F)F.Cl
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
FC(c1ccc2c(c1)CNCC2)(F)F.Cl
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__