AE66293
1251009-46-7 | 2-(tert-Butoxycarbonyl)-5-oxa-2-azaspiro[3.4]octane-7-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AE66293
ChemicalName
2-(tert-Butoxycarbonyl)-5-oxa-2-azaspiro[3.4]octane-7-carboxylic acid
CasNumber
1251009-46-7
MolecularFormula
C12H19NO5
MolecularWeight
257.28295999999995
MdlNumber
MFCD14581235
Smiles
O=C(N1CC2(C1)OCC(C2)C(=O)O)OC(C)(C)C
Complexity
367
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
UndefinedAtomStereocenterCount
1
Xlogp3
0.3
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CatalogNumber: AE66293
ChemicalName: 2-(tert-Butoxycarbonyl)-5-oxa-2-azaspiro[3.4]octane-7-carboxylic acid
CasNumber: 1251009-46-7
MolecularFormula: C12H19NO5
MolecularWeight: 257.28295999999995
MdlNumber: MFCD14581235
Smiles: O=C(N1CC2(C1)OCC(C2)C(=O)O)OC(C)(C)C
Complexity: 367
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.3
CatalogNumber:
AE66293
ChemicalName:
2-(tert-Butoxycarbonyl)-5-oxa-2-azaspiro[3.4]octane-7-carboxylic acid
CasNumber:
1251009-46-7
MolecularFormula:
C12H19NO5
MolecularWeight:
257.28295999999995
MdlNumber:
MFCD14581235
Smiles:
O=C(N1CC2(C1)OCC(C2)C(=O)O)OC(C)(C)C
Complexity:
367
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.3
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Smiles: [N-]=[N+]=NCc1ccc(cc1)C1=C(c2ccccc2)C(=C([Si]1(C)C)c1ccc(cc1)CN=[N+]=[N-])c1ccccc1
Complexity: __
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Smiles:
[N-]=[N+]=NCc1ccc(cc1)C1=C(c2ccccc2)C(=C([Si]1(C)C)c1ccc(cc1)CN=[N+]=[N-])c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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Smiles: O=C(N1CC2(C1)OCCC2N)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
O=C(N1CC2(C1)OCCC2N)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(N1CC2(C1)C(N)CCS2(=O)=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(N1CC2(C1)C(N)CCS2(=O)=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__