AA29850
1251010-17-9 | tert-Butyl 1-oxo-6-azaspiro[3.4]octane-6-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA29850
ChemicalName
tert-Butyl 1-oxo-6-azaspiro[3.4]octane-6-carboxylate
CasNumber
1251010-17-9
MolecularFormula
C12H19NO3
MolecularWeight
225.2842
MdlNumber
MFCD17016199
Smiles
O=C(N1CCC2(C1)CCC2=O)OC(C)(C)C
Complexity
332
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
0.9
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CatalogNumber: AA29850
ChemicalName: tert-Butyl 1-oxo-6-azaspiro[3.4]octane-6-carboxylate
CasNumber: 1251010-17-9
MolecularFormula: C12H19NO3
MolecularWeight: 225.2842
MdlNumber: MFCD17016199
Smiles: O=C(N1CCC2(C1)CCC2=O)OC(C)(C)C
Complexity: 332
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.9
CatalogNumber:
AA29850
ChemicalName:
tert-Butyl 1-oxo-6-azaspiro[3.4]octane-6-carboxylate
CasNumber:
1251010-17-9
MolecularFormula:
C12H19NO3
MolecularWeight:
225.2842
MdlNumber:
MFCD17016199
Smiles:
O=C(N1CCC2(C1)CCC2=O)OC(C)(C)C
Complexity:
332
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.9
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Smiles: O=C(N1CC[C@@H]2[C@H]1CCN2)OCc1ccccc1
Complexity: __
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Smiles:
O=C(N1CC[C@@H]2[C@H]1CCN2)OCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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Smiles: CCOC(=O)c1c(C)[nH]c(c1C(=O)CCl)C
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Smiles:
CCOC(=O)c1c(C)[nH]c(c1C(=O)CCl)C
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
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Smiles: COc1cc(ccc1OCc1ccccc1)c1ccccc1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Smiles:
COc1cc(ccc1OCc1ccccc1)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__