AB44659
954236-44-3 | 3-Oxo-1-oxa-8-aza-spiro[4.5]decane-8-carboxylic acid tert-butyl ester
Manufacturer: A2B Chem
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CatalogNumber
AB44659
ChemicalName
3-Oxo-1-oxa-8-aza-spiro[4.5]decane-8-carboxylic acid tert-butyl ester
CasNumber
954236-44-3
MolecularFormula
C13H21NO4
MolecularWeight
255.3101
MdlNumber
MFCD10001421
Smiles
O=C(N1CCC2(CC1)OCC(=O)C2)OC(C)(C)C
Complexity
351
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
0.9
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CatalogNumber: AB44659
ChemicalName: 3-Oxo-1-oxa-8-aza-spiro[4.5]decane-8-carboxylic acid tert-butyl ester
CasNumber: 954236-44-3
MolecularFormula: C13H21NO4
MolecularWeight: 255.3101
MdlNumber: MFCD10001421
Smiles: O=C(N1CCC2(CC1)OCC(=O)C2)OC(C)(C)C
Complexity: 351
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 0.9
CatalogNumber:
AB44659
ChemicalName:
3-Oxo-1-oxa-8-aza-spiro[4.5]decane-8-carboxylic acid tert-butyl ester
CasNumber:
954236-44-3
MolecularFormula:
C13H21NO4
MolecularWeight:
255.3101
MdlNumber:
MFCD10001421
Smiles:
O=C(N1CCC2(CC1)OCC(=O)C2)OC(C)(C)C
Complexity:
351
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
0.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1ccn[nH]c1=O
Complexity: 241
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: -0.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1ccn[nH]c1=O
Complexity:
241
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
-0.4
CatalogNumber: AB44661
ChemicalName: 3-Oxocyclobutanecarboxylic acid
CasNumber: 23761-23-1
MolecularFormula: C5H6O3
MolecularWeight: 114.0993
MdlNumber: MFCD00100900
Smiles: O=C1CC(C1)C(=O)O
Complexity: 131
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: -0.8
CatalogNumber:
AB44661
ChemicalName:
3-Oxocyclobutanecarboxylic acid
CasNumber:
23761-23-1
MolecularFormula:
C5H6O3
MolecularWeight:
114.0993
MdlNumber:
MFCD00100900
Smiles:
O=C1CC(C1)C(=O)O
Complexity:
131
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
-0.8
CatalogNumber: AB44662
ChemicalName: 3-Oxocyclopentanecarboxylic acid
CasNumber: 98-78-2
MolecularFormula: C6H8O3
MolecularWeight: 128.1259
MdlNumber: MFCD01320173
Smiles: O=C1CCC(C1)C(=O)O
Complexity: 150
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: -0.4
CatalogNumber:
AB44662
ChemicalName:
3-Oxocyclopentanecarboxylic acid
CasNumber:
98-78-2
MolecularFormula:
C6H8O3
MolecularWeight:
128.1259
MdlNumber:
MFCD01320173
Smiles:
O=C1CCC(C1)C(=O)O
Complexity:
150
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
-0.4