AX12263
856452-73-8 | 1-(2-Chloro-4-nitrophenyl)-1H-1,2,4-triazole
Manufacturer: A2B Chem
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CatalogNumber
AX12263
ChemicalName
1-(2-Chloro-4-nitrophenyl)-1H-1,2,4-triazole
CasNumber
856452-73-8
MolecularFormula
C8H5ClN4O2
MolecularWeight
224.6039
MdlNumber
MFCD18622135
Smiles
Clc1cc(ccc1n1cncn1)[N+](=O)[O-]
Complexity
247
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
RotatableBondCount
1
Xlogp3
2.1
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CatalogNumber: AX12263
ChemicalName: 1-(2-Chloro-4-nitrophenyl)-1H-1,2,4-triazole
CasNumber: 856452-73-8
MolecularFormula: C8H5ClN4O2
MolecularWeight: 224.6039
MdlNumber: MFCD18622135
Smiles: Clc1cc(ccc1n1cncn1)[N+](=O)[O-]
Complexity: 247
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
Xlogp3: 2.1
CatalogNumber:
AX12263
ChemicalName:
1-(2-Chloro-4-nitrophenyl)-1H-1,2,4-triazole
CasNumber:
856452-73-8
MolecularFormula:
C8H5ClN4O2
MolecularWeight:
224.6039
MdlNumber:
MFCD18622135
Smiles:
Clc1cc(ccc1n1cncn1)[N+](=O)[O-]
Complexity:
247
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
Xlogp3:
2.1
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Smiles: N#CC(c1ncc(c(c1C)Cl)F)C1CC1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
N#CC(c1ncc(c(c1C)Cl)F)C1CC1
Complexity:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: CNC(=O)CN1C(=O)CCC21CCCNC2
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Smiles:
CNC(=O)CN1C(=O)CCC21CCCNC2
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__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: C1CN[C@@H]2[C@@H](O1)[C@@H](CC2)OCC1CCCC1
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CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
C1CN[C@@H]2[C@@H](O1)[C@@H](CC2)OCC1CCCC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__