AD40051
169447-86-3 | (S)-1-Boc-2-benzylpiperazine
Manufacturer: A2B Chem
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CatalogNumber
AD40051
ChemicalName
(S)-1-Boc-2-benzylpiperazine
CasNumber
169447-86-3
MolecularFormula
C16H24N2O2
MolecularWeight
276.374
MdlNumber
MFCD03787923
Smiles
O=C(N1CCNC[C@@H]1Cc1ccccc1)OC(C)(C)C
Complexity
319
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
2.5
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CatalogNumber: AD40051
ChemicalName: (S)-1-Boc-2-benzylpiperazine
CasNumber: 169447-86-3
MolecularFormula: C16H24N2O2
MolecularWeight: 276.374
MdlNumber: MFCD03787923
Smiles: O=C(N1CCNC[C@@H]1Cc1ccccc1)OC(C)(C)C
Complexity: 319
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 2.5
CatalogNumber:
AD40051
ChemicalName:
(S)-1-Boc-2-benzylpiperazine
CasNumber:
169447-86-3
MolecularFormula:
C16H24N2O2
MolecularWeight:
276.374
MdlNumber:
MFCD03787923
Smiles:
O=C(N1CCNC[C@@H]1Cc1ccccc1)OC(C)(C)C
Complexity:
319
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
2.5
CatalogNumber: __
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Smiles: c1ccc[nH+]c1.F[P-](F)(F)(F)(F)F
Complexity: __
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Smiles:
c1ccc[nH+]c1.F[P-](F)(F)(F)(F)F
Complexity:
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RotatableBondCount:
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Smiles: Cl[Re-2](Cl)(Cl)(Cl)(Cl)Cl.[K+].[K+]
Complexity: __
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Smiles:
Cl[Re-2](Cl)(Cl)(Cl)(Cl)Cl.[K+].[K+]
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DefinedAtomStereocenterCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: CO[BH-](OC)OC.[Na+]
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CO[BH-](OC)OC.[Na+]
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__