AB74971
62348-13-4 | Isoxazole-5-carbonyl chloride
Manufacturer: A2B Chem
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CatalogNumber
AB74971
ChemicalName
Isoxazole-5-carbonyl chloride
CasNumber
62348-13-4
MolecularFormula
C4H2ClNO2
MolecularWeight
131.5172
MdlNumber
MFCD00067868
Smiles
ClC(=O)c1ccno1
Complexity
106
Covalently-bondedUnitCount
1
HeavyAtomCount
8
HydrogenBondAcceptorCount
3
RotatableBondCount
1
Xlogp3
1.2
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CatalogNumber: AB74971
ChemicalName: Isoxazole-5-carbonyl chloride
CasNumber: 62348-13-4
MolecularFormula: C4H2ClNO2
MolecularWeight: 131.5172
MdlNumber: MFCD00067868
Smiles: ClC(=O)c1ccno1
Complexity: 106
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 1.2
CatalogNumber:
AB74971
ChemicalName:
Isoxazole-5-carbonyl chloride
CasNumber:
62348-13-4
MolecularFormula:
C4H2ClNO2
MolecularWeight:
131.5172
MdlNumber:
MFCD00067868
Smiles:
ClC(=O)c1ccno1
Complexity:
106
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
1.2
CatalogNumber: AB74972
ChemicalName: Isoxazole-5-carboxylic acid
CasNumber: 21169-71-1
MolecularFormula: C4H3NO3
MolecularWeight: 113.0715
MdlNumber: MFCD00156151
Smiles: OC(=O)c1ccno1
Complexity: 104
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
Xlogp3: 0.2
CatalogNumber:
AB74972
ChemicalName:
Isoxazole-5-carboxylic acid
CasNumber:
21169-71-1
MolecularFormula:
C4H3NO3
MolecularWeight:
113.0715
MdlNumber:
MFCD00156151
Smiles:
OC(=O)c1ccno1
Complexity:
104
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
Xlogp3:
0.2
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Smiles: OC(=O)CC(=C)C(=O)O
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
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Smiles:
OC(=O)CC(=C)C(=O)O
Complexity:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: CCCCC(COC(=O)CC(=C)C(=O)OCC(CCCC)CC)CC
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HeavyAtomCount: __
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Xlogp3: __
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MolecularFormula:
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Smiles:
CCCCC(COC(=O)CC(=C)C(=O)OCC(CCCC)CC)CC
Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__