AI12765
1201916-87-1 | tert-Butyl 4-(4-nitro-1H-pyrazol-1-yl)piperidine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI12765
ChemicalName
tert-Butyl 4-(4-nitro-1H-pyrazol-1-yl)piperidine-1-carboxylate
CasNumber
1201916-87-1
MolecularFormula
C13H20N4O4
MolecularWeight
296.3223
MdlNumber
MFCD14155810
Smiles
O=C(N1CCC(CC1)n1ncc(c1)[N+](=O)[O-])OC(C)(C)C
Complexity
396
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
5
RotatableBondCount
3
Xlogp3
1.4
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CatalogNumber: AI12765
ChemicalName: tert-Butyl 4-(4-nitro-1H-pyrazol-1-yl)piperidine-1-carboxylate
CasNumber: 1201916-87-1
MolecularFormula: C13H20N4O4
MolecularWeight: 296.3223
MdlNumber: MFCD14155810
Smiles: O=C(N1CCC(CC1)n1ncc(c1)[N+](=O)[O-])OC(C)(C)C
Complexity: 396
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
Xlogp3: 1.4
CatalogNumber:
AI12765
ChemicalName:
tert-Butyl 4-(4-nitro-1H-pyrazol-1-yl)piperidine-1-carboxylate
CasNumber:
1201916-87-1
MolecularFormula:
C13H20N4O4
MolecularWeight:
296.3223
MdlNumber:
MFCD14155810
Smiles:
O=C(N1CCC(CC1)n1ncc(c1)[N+](=O)[O-])OC(C)(C)C
Complexity:
396
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
Xlogp3:
1.4
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Smiles: COC(=O)c1nc(Cl)ccc1CBr
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HeavyAtomCount: __
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Smiles:
COC(=O)c1nc(Cl)ccc1CBr
Complexity:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
__
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Smiles: O=C(N1CCCC(C1)n1ncc(c1)[N+](=O)[O-])OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
O=C(N1CCCC(C1)n1ncc(c1)[N+](=O)[O-])OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: Nc1cnn(c1)C1CCCN(C1)C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
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CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
Nc1cnn(c1)C1CCCN(C1)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__