AI35948
1446012-46-9 | tert-Butyl 3-(but-3-en-1-yl)-3-hydroxyazetidine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI35948
ChemicalName
tert-Butyl 3-(but-3-en-1-yl)-3-hydroxyazetidine-1-carboxylate
CasNumber
1446012-46-9
MolecularFormula
C12H21NO3
MolecularWeight
227.3
MdlNumber
MFCD28991827
Smiles
C=CCCC1(O)CN(C1)C(=O)OC(C)(C)C
Complexity
275
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
5
Xlogp3
1.5
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CatalogNumber: AI35948
ChemicalName: tert-Butyl 3-(but-3-en-1-yl)-3-hydroxyazetidine-1-carboxylate
CasNumber: 1446012-46-9
MolecularFormula: C12H21NO3
MolecularWeight: 227.3
MdlNumber: MFCD28991827
Smiles: C=CCCC1(O)CN(C1)C(=O)OC(C)(C)C
Complexity: 275
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 1.5
CatalogNumber:
AI35948
ChemicalName:
tert-Butyl 3-(but-3-en-1-yl)-3-hydroxyazetidine-1-carboxylate
CasNumber:
1446012-46-9
MolecularFormula:
C12H21NO3
MolecularWeight:
227.3
MdlNumber:
MFCD28991827
Smiles:
C=CCCC1(O)CN(C1)C(=O)OC(C)(C)C
Complexity:
275
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
1.5
CatalogNumber: AI35949
ChemicalName: tert-Butyl 6-(hydroxymethyl)-5-oxa-2-azaspiro[3.4]octane-2-carboxylate
CasNumber: 1446012-48-1
MolecularFormula: C12H21NO4
MolecularWeight: 243.29943999999995
MdlNumber: MFCD27986992
Smiles: OCC1CCC2(O1)CN(C2)C(=O)OC(C)(C)C
Complexity: 304
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 0.5
CatalogNumber:
AI35949
ChemicalName:
tert-Butyl 6-(hydroxymethyl)-5-oxa-2-azaspiro[3.4]octane-2-carboxylate
CasNumber:
1446012-48-1
MolecularFormula:
C12H21NO4
MolecularWeight:
243.29943999999995
MdlNumber:
MFCD27986992
Smiles:
OCC1CCC2(O1)CN(C2)C(=O)OC(C)(C)C
Complexity:
304
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
0.5
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Smiles: Fc1ccc(cc1OS(=O)(=O)C(F)(F)F)C(F)(F)F
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Fc1ccc(cc1OS(=O)(=O)C(F)(F)F)C(F)(F)F
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Smiles: Clc1cc(cc(c1)C(F)(F)F)OS(=O)(=O)C(F)(F)F
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Smiles:
Clc1cc(cc(c1)C(F)(F)F)OS(=O)(=O)C(F)(F)F
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