AE12046
1118786-86-9 | 2-(Boc-amino)-6-oxospiro[3.3]heptane
Manufacturer: A2B Chem
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CatalogNumber
AE12046
ChemicalName
2-(Boc-amino)-6-oxospiro[3.3]heptane
CasNumber
1118786-86-9
MolecularFormula
C12H19NO3
MolecularWeight
225.2842
MdlNumber
MFCD11858160
Smiles
O=C(OC(C)(C)C)NC1CC2(C1)CC(=O)C2
Complexity
314
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1.1
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CatalogNumber: AE12046
ChemicalName: 2-(Boc-amino)-6-oxospiro[3.3]heptane
CasNumber: 1118786-86-9
MolecularFormula: C12H19NO3
MolecularWeight: 225.2842
MdlNumber: MFCD11858160
Smiles: O=C(OC(C)(C)C)NC1CC2(C1)CC(=O)C2
Complexity: 314
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.1
CatalogNumber:
AE12046
ChemicalName:
2-(Boc-amino)-6-oxospiro[3.3]heptane
CasNumber:
1118786-86-9
MolecularFormula:
C12H19NO3
MolecularWeight:
225.2842
MdlNumber:
MFCD11858160
Smiles:
O=C(OC(C)(C)C)NC1CC2(C1)CC(=O)C2
Complexity:
314
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.1
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: CCOC(=O)c1cc(Cl)ccc1I
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
CCOC(=O)c1cc(Cl)ccc1I
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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MolecularFormula: __
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Smiles: O=C(c1ccc(cc1)Cl)NC(C(=O)O)CCS(=O)(=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
O=C(c1ccc(cc1)Cl)NC(C(=O)O)CCS(=O)(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
__
Xlogp3:
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ChemicalName: __
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Smiles: ClCC(=O)N1CCc2c(C1)cc(c(c2)OC)OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ClCC(=O)N1CCc2c(C1)cc(c(c2)OC)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__