AA03696
1008526-71-3 | 1-Boc-3-hydroxy-3-(aminomethyl)azetidine
Manufacturer: A2B Chem
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CatalogNumber
AA03696
ChemicalName
1-Boc-3-hydroxy-3-(aminomethyl)azetidine
CasNumber
1008526-71-3
MolecularFormula
C9H18N2O3
MolecularWeight
202.2508
MdlNumber
MFCD17015986
Smiles
NCC1(O)CN(C1)C(=O)OC(C)(C)C
Complexity
229
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
-0.9
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CatalogNumber: AA03696
ChemicalName: 1-Boc-3-hydroxy-3-(aminomethyl)azetidine
CasNumber: 1008526-71-3
MolecularFormula: C9H18N2O3
MolecularWeight: 202.2508
MdlNumber: MFCD17015986
Smiles: NCC1(O)CN(C1)C(=O)OC(C)(C)C
Complexity: 229
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: -0.9
CatalogNumber:
AA03696
ChemicalName:
1-Boc-3-hydroxy-3-(aminomethyl)azetidine
CasNumber:
1008526-71-3
MolecularFormula:
C9H18N2O3
MolecularWeight:
202.2508
MdlNumber:
MFCD17015986
Smiles:
NCC1(O)CN(C1)C(=O)OC(C)(C)C
Complexity:
229
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
-0.9
CatalogNumber: AA03697
ChemicalName: 1-Boc-3-hydroxy-3-(nitromethyl)azetidine
CasNumber: 1008526-70-2
MolecularFormula: C9H16N2O5
MolecularWeight: 232.2337
MdlNumber: MFCD17015985
Smiles: O=C(N1CC(C1)(O)C[N+](=O)[O-])OC(C)(C)C
Complexity: 298
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 0.4
CatalogNumber:
AA03697
ChemicalName:
1-Boc-3-hydroxy-3-(nitromethyl)azetidine
CasNumber:
1008526-70-2
MolecularFormula:
C9H16N2O5
MolecularWeight:
232.2337
MdlNumber:
MFCD17015985
Smiles:
O=C(N1CC(C1)(O)C[N+](=O)[O-])OC(C)(C)C
Complexity:
298
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
0.4
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Smiles: O=C(N1CCc2c(C1)ccc(c2)C(=O)C)OC(C)(C)C
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Smiles:
O=C(N1CCc2c(C1)ccc(c2)C(=O)C)OC(C)(C)C
Complexity:
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HeavyAtomCount:
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RotatableBondCount:
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Smiles: Ic1ccc2c(c1)CCN(C2)C(=O)OC(C)(C)C
Complexity: __
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HeavyAtomCount: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
Ic1ccc2c(c1)CCN(C2)C(=O)OC(C)(C)C
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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