AI65454
97421-21-1 | 1-Isopropyl-4-nitro-1H-pyrazole
Manufacturer: A2B Chem
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CatalogNumber
AI65454
ChemicalName
1-Isopropyl-4-nitro-1H-pyrazole
CasNumber
97421-21-1
MolecularFormula
C6H9N3O2
MolecularWeight
155.1546
MdlNumber
MFCD10001542
Smiles
CC(n1ncc(c1)[N+](=O)[O-])C
Complexity
154
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
RotatableBondCount
1
Xlogp3
0.8
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CatalogNumber: AI65454
ChemicalName: 1-Isopropyl-4-nitro-1H-pyrazole
CasNumber: 97421-21-1
MolecularFormula: C6H9N3O2
MolecularWeight: 155.1546
MdlNumber: MFCD10001542
Smiles: CC(n1ncc(c1)[N+](=O)[O-])C
Complexity: 154
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 0.8
CatalogNumber:
AI65454
ChemicalName:
1-Isopropyl-4-nitro-1H-pyrazole
CasNumber:
97421-21-1
MolecularFormula:
C6H9N3O2
MolecularWeight:
155.1546
MdlNumber:
MFCD10001542
Smiles:
CC(n1ncc(c1)[N+](=O)[O-])C
Complexity:
154
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
0.8
CatalogNumber: AI65455
ChemicalName: 1-Cyclohexyl-4-nitropyrazole
CasNumber: 97421-22-2
MolecularFormula: C9H13N3O2
MolecularWeight: 195.2184
MdlNumber: MFCD24448797
Smiles: [O-][N+](=O)c1cnn(c1)C1CCCCC1
Complexity: 211
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 1.8
CatalogNumber:
AI65455
ChemicalName:
1-Cyclohexyl-4-nitropyrazole
CasNumber:
97421-22-2
MolecularFormula:
C9H13N3O2
MolecularWeight:
195.2184
MdlNumber:
MFCD24448797
Smiles:
[O-][N+](=O)c1cnn(c1)C1CCCCC1
Complexity:
211
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
1.8
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Smiles: Nc1cnn(c1)C1CCCCC1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
Nc1cnn(c1)C1CCCCC1
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: O=C1NC2C(C1)C=CC2
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
O=C1NC2C(C1)C=CC2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__