AG66861
57611-19-5 | 5-(Chloromethyl)-3-(4-nitrophenyl)-1,2,4-oxadiazole
Manufacturer: A2B Chem
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CatalogNumber
AG66861
ChemicalName
5-(Chloromethyl)-3-(4-nitrophenyl)-1,2,4-oxadiazole
CasNumber
57611-19-5
MolecularFormula
C9H6ClN3O3
MolecularWeight
239.6152
MdlNumber
MFCD00452243
Smiles
ClCc1onc(n1)c1ccc(cc1)[N+](=O)[O-]
Complexity
253
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
5
RotatableBondCount
2
Xlogp3
2.1
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CatalogNumber: AG66861
ChemicalName: 5-(Chloromethyl)-3-(4-nitrophenyl)-1,2,4-oxadiazole
CasNumber: 57611-19-5
MolecularFormula: C9H6ClN3O3
MolecularWeight: 239.6152
MdlNumber: MFCD00452243
Smiles: ClCc1onc(n1)c1ccc(cc1)[N+](=O)[O-]
Complexity: 253
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 5
RotatableBondCount: 2
Xlogp3: 2.1
CatalogNumber:
AG66861
ChemicalName:
5-(Chloromethyl)-3-(4-nitrophenyl)-1,2,4-oxadiazole
CasNumber:
57611-19-5
MolecularFormula:
C9H6ClN3O3
MolecularWeight:
239.6152
MdlNumber:
MFCD00452243
Smiles:
ClCc1onc(n1)c1ccc(cc1)[N+](=O)[O-]
Complexity:
253
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
5
RotatableBondCount:
2
Xlogp3:
2.1
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Smiles: BrCC(=O)c1cc(O)cc(c1)O
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Smiles:
BrCC(=O)c1cc(O)cc(c1)O
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Smiles: CCCCCCCCCCCCCC[N+](CCO)(CCO)C.[Cl-]
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CCCCCCCCCCCCCC[N+](CCO)(CCO)C.[Cl-]
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Smiles: NC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1
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MolecularWeight:
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MdlNumber:
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Smiles:
NC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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