AB43254
502649-32-3 | 1-Boc-3-isopropyl-piperazine
Manufacturer: A2B Chem
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CatalogNumber
AB43254
ChemicalName
1-Boc-3-isopropyl-piperazine
CasNumber
502649-32-3
MolecularFormula
C12H24N2O2
MolecularWeight
228.3312
MdlNumber
MFCD08273958
Smiles
CC(C1NCCN(C1)C(=O)OC(C)(C)C)C
Complexity
246
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
UndefinedAtomStereocenterCount
1
Xlogp3
1.9
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CatalogNumber: AB43254
ChemicalName: 1-Boc-3-isopropyl-piperazine
CasNumber: 502649-32-3
MolecularFormula: C12H24N2O2
MolecularWeight: 228.3312
MdlNumber: MFCD08273958
Smiles: CC(C1NCCN(C1)C(=O)OC(C)(C)C)C
Complexity: 246
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.9
CatalogNumber:
AB43254
ChemicalName:
1-Boc-3-isopropyl-piperazine
CasNumber:
502649-32-3
MolecularFormula:
C12H24N2O2
MolecularWeight:
228.3312
MdlNumber:
MFCD08273958
Smiles:
CC(C1NCCN(C1)C(=O)OC(C)(C)C)C
Complexity:
246
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CNC1CCN(C1)C(=O)OC(C)(C)C
Complexity: 211
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 0.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CNC1CCN(C1)C(=O)OC(C)(C)C
Complexity:
211
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
0.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(N1CCCC(C1)(C)C(=O)O)OC(C)(C)C
Complexity: 321
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 1.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(N1CCCC(C1)(C)C(=O)O)OC(C)(C)C
Complexity:
321
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
1.5
CatalogNumber: AB43257
ChemicalName: 1-Boc-3-piperidone
CasNumber: 98977-36-7
MolecularFormula: C10H17NO3
MolecularWeight: 199.2469
MdlNumber: MFCD01631193
Smiles: O=C1CCCN(C1)C(=O)OC(C)(C)C
Complexity: 242
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 2
UndefinedAtomStereocenterCount: __
Xlogp3: 1
CatalogNumber:
AB43257
ChemicalName:
1-Boc-3-piperidone
CasNumber:
98977-36-7
MolecularFormula:
C10H17NO3
MolecularWeight:
199.2469
MdlNumber:
MFCD01631193
Smiles:
O=C1CCCN(C1)C(=O)OC(C)(C)C
Complexity:
242
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
__
Xlogp3:
1