AI10062
1160246-93-4 | tert-Butyl 3-cyano-1-oxa-8-azaspiro[4.5]decane-8-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI10062
ChemicalName
tert-Butyl 3-cyano-1-oxa-8-azaspiro[4.5]decane-8-carboxylate
CasNumber
1160246-93-4
MolecularFormula
C14H22N2O3
MolecularWeight
266.3361
MdlNumber
MFCD12198531
Smiles
N#CC1COC2(C1)CCN(CC2)C(=O)OC(C)(C)C
Complexity
397
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
4
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
1.2
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CatalogNumber: AI10062
ChemicalName: tert-Butyl 3-cyano-1-oxa-8-azaspiro[4.5]decane-8-carboxylate
CasNumber: 1160246-93-4
MolecularFormula: C14H22N2O3
MolecularWeight: 266.3361
MdlNumber: MFCD12198531
Smiles: N#CC1COC2(C1)CCN(CC2)C(=O)OC(C)(C)C
Complexity: 397
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.2
CatalogNumber:
AI10062
ChemicalName:
tert-Butyl 3-cyano-1-oxa-8-azaspiro[4.5]decane-8-carboxylate
CasNumber:
1160246-93-4
MolecularFormula:
C14H22N2O3
MolecularWeight:
266.3361
MdlNumber:
MFCD12198531
Smiles:
N#CC1COC2(C1)CCN(CC2)C(=O)OC(C)(C)C
Complexity:
397
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.2
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Smiles: OC(=O)C1COC2(C1)CCCN(C2)C(=O)OC(C)(C)C
Complexity: __
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Smiles:
OC(=O)C1COC2(C1)CCCN(C2)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
__
Xlogp3:
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Smiles: OC(=O)C1CCC2(CO1)CCN(CC2)C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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MolecularFormula:
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MdlNumber:
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Smiles:
OC(=O)C1CCC2(CO1)CCN(CC2)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
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Smiles: O=C(N1CCCC2(CC1)OCC(C2)C(=O)O)OCc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
O=C(N1CCCC2(CC1)OCC(C2)C(=O)O)OCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__