AB75827
1072944-87-6 | Methyl 4-(4-chlorophenyl)isoxazole-5-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB75827
ChemicalName
Methyl 4-(4-chlorophenyl)isoxazole-5-carboxylate
CasNumber
1072944-87-6
MolecularFormula
C11H8ClNO3
MolecularWeight
237.6391
MdlNumber
MFCD11504938
Smiles
COC(=O)c1oncc1c1ccc(cc1)Cl
Complexity
254
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
RotatableBondCount
3
Xlogp3
2.8
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CatalogNumber: AB75827
ChemicalName: Methyl 4-(4-chlorophenyl)isoxazole-5-carboxylate
CasNumber: 1072944-87-6
MolecularFormula: C11H8ClNO3
MolecularWeight: 237.6391
MdlNumber: MFCD11504938
Smiles: COC(=O)c1oncc1c1ccc(cc1)Cl
Complexity: 254
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 2.8
CatalogNumber:
AB75827
ChemicalName:
Methyl 4-(4-chlorophenyl)isoxazole-5-carboxylate
CasNumber:
1072944-87-6
MolecularFormula:
C11H8ClNO3
MolecularWeight:
237.6391
MdlNumber:
MFCD11504938
Smiles:
COC(=O)c1oncc1c1ccc(cc1)Cl
Complexity:
254
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
2.8
CatalogNumber: AB75828
ChemicalName: Methyl 4-(4-fluorophenyl)-4-oxobutanoate
CasNumber: 39560-31-1
MolecularFormula: C11H11FO3
MolecularWeight: 210.2016
MdlNumber: MFCD03090514
Smiles: COC(=O)CCC(=O)c1ccc(cc1)F
Complexity: 232
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
RotatableBondCount: 5
Xlogp3: 1.8
CatalogNumber:
AB75828
ChemicalName:
Methyl 4-(4-fluorophenyl)-4-oxobutanoate
CasNumber:
39560-31-1
MolecularFormula:
C11H11FO3
MolecularWeight:
210.2016
MdlNumber:
MFCD03090514
Smiles:
COC(=O)CCC(=O)c1ccc(cc1)F
Complexity:
232
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
RotatableBondCount:
5
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)CCC(=O)c1ccc(cc1)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)CCC(=O)c1ccc(cc1)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1ccc(cc1)CN1CCN(CC1)C
Complexity: 267
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1ccc(cc1)CN1CCN(CC1)C
Complexity:
267
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.4