AB75928
1065074-27-2 | Methyl 5-(3-chlorophenyl)isoxazole-4-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB75928
ChemicalName
Methyl 5-(3-chlorophenyl)isoxazole-4-carboxylate
CasNumber
1065074-27-2
MolecularFormula
C11H8ClNO3
MolecularWeight
237.6391
MdlNumber
MFCD11504883
Smiles
COC(=O)c1cnoc1c1cccc(c1)Cl
Complexity
262
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
RotatableBondCount
3
Xlogp3
2.5
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CatalogNumber: AB75928
ChemicalName: Methyl 5-(3-chlorophenyl)isoxazole-4-carboxylate
CasNumber: 1065074-27-2
MolecularFormula: C11H8ClNO3
MolecularWeight: 237.6391
MdlNumber: MFCD11504883
Smiles: COC(=O)c1cnoc1c1cccc(c1)Cl
Complexity: 262
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 2.5
CatalogNumber:
AB75928
ChemicalName:
Methyl 5-(3-chlorophenyl)isoxazole-4-carboxylate
CasNumber:
1065074-27-2
MolecularFormula:
C11H8ClNO3
MolecularWeight:
237.6391
MdlNumber:
MFCD11504883
Smiles:
COC(=O)c1cnoc1c1cccc(c1)Cl
Complexity:
262
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
2.5
CatalogNumber: AB75929
ChemicalName: Methyl 5-(3-chlorophenyl)oxazole-4-carboxylate
CasNumber: 89204-92-2
MolecularFormula: C11H8ClNO3
MolecularWeight: 237.6391
MdlNumber: MFCD09800995
Smiles: COC(=O)c1ncoc1c1cccc(c1)Cl
Complexity: 262
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 2.8
CatalogNumber:
AB75929
ChemicalName:
Methyl 5-(3-chlorophenyl)oxazole-4-carboxylate
CasNumber:
89204-92-2
MolecularFormula:
C11H8ClNO3
MolecularWeight:
237.6391
MdlNumber:
MFCD09800995
Smiles:
COC(=O)c1ncoc1c1cccc(c1)Cl
Complexity:
262
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
2.8
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Smiles: COC(=O)c1noc(c1)c1cccc(c1)C#N
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Smiles:
COC(=O)c1noc(c1)c1cccc(c1)C#N
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: COC(=O)c1noc(c1)c1cccc(c1)[N+](=O)[O-]
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
COC(=O)c1noc(c1)c1cccc(c1)[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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