AB65840
104-20-1 | 4-(4-Methoxyphenyl)-2-butanone
Manufacturer: A2B Chem
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CatalogNumber
AB65840
ChemicalName
4-(4-Methoxyphenyl)-2-butanone
CasNumber
104-20-1
MolecularFormula
C11H14O2
MolecularWeight
178.2277
MdlNumber
MFCD00008791
Smiles
COc1ccc(cc1)CCC(=O)C
NscNumber
405366
Complexity
158
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
2
RotatableBondCount
4
Xlogp3
2.1
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CatalogNumber: AB65840
ChemicalName: 4-(4-Methoxyphenyl)-2-butanone
CasNumber: 104-20-1
MolecularFormula: C11H14O2
MolecularWeight: 178.2277
MdlNumber: MFCD00008791
Smiles: COc1ccc(cc1)CCC(=O)C
NscNumber: 405366
Complexity: 158
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
RotatableBondCount: 4
Xlogp3: 2.1
CatalogNumber:
AB65840
ChemicalName:
4-(4-Methoxyphenyl)-2-butanone
CasNumber:
104-20-1
MolecularFormula:
C11H14O2
MolecularWeight:
178.2277
MdlNumber:
MFCD00008791
Smiles:
COc1ccc(cc1)CCC(=O)C
NscNumber:
405366
Complexity:
158
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
RotatableBondCount:
4
Xlogp3:
2.1
CatalogNumber: AB65841
ChemicalName: 1-(P-Methoxyphenyl)-1-buten-3-one
CasNumber: 943-88-4
MolecularFormula: C11H12O2
MolecularWeight: 176.2118
MdlNumber: MFCD00017251
Smiles: COc1ccc(cc1)/C=C/C(=O)C
NscNumber: __
Complexity: 188
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
RotatableBondCount: 3
Xlogp3: 2.1
CatalogNumber:
AB65841
ChemicalName:
1-(P-Methoxyphenyl)-1-buten-3-one
CasNumber:
943-88-4
MolecularFormula:
C11H12O2
MolecularWeight:
176.2118
MdlNumber:
MFCD00017251
Smiles:
COc1ccc(cc1)/C=C/C(=O)C
NscNumber:
__
Complexity:
188
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
RotatableBondCount:
3
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1)CCCC(=O)O
NscNumber: __
Complexity: 171
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cc1)CCCC(=O)O
NscNumber:
__
Complexity:
171
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1)N1CCOCC1
NscNumber: __
Complexity: 161
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cc1)N1CCOCC1
NscNumber:
__
Complexity:
161
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.3