AI41197
1823269-85-7 | tert-Butyl 4-oxo-1-oxa-7-azaspiro[4.4]nonane-7-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI41197
ChemicalName
tert-Butyl 4-oxo-1-oxa-7-azaspiro[4.4]nonane-7-carboxylate
CasNumber
1823269-85-7
MolecularFormula
C12H19NO4
MolecularWeight
241.2836
MdlNumber
MFCD27997305
Smiles
O=C(N1CCC2(C1)OCCC2=O)OC(C)(C)C
Complexity
347
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
0.5
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CatalogNumber: AI41197
ChemicalName: tert-Butyl 4-oxo-1-oxa-7-azaspiro[4.4]nonane-7-carboxylate
CasNumber: 1823269-85-7
MolecularFormula: C12H19NO4
MolecularWeight: 241.2836
MdlNumber: MFCD27997305
Smiles: O=C(N1CCC2(C1)OCCC2=O)OC(C)(C)C
Complexity: 347
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.5
CatalogNumber:
AI41197
ChemicalName:
tert-Butyl 4-oxo-1-oxa-7-azaspiro[4.4]nonane-7-carboxylate
CasNumber:
1823269-85-7
MolecularFormula:
C12H19NO4
MolecularWeight:
241.2836
MdlNumber:
MFCD27997305
Smiles:
O=C(N1CCC2(C1)OCCC2=O)OC(C)(C)C
Complexity:
347
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.5
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Smiles: O=C(C1CC1(F)C(=O)O)OCc1ccccc1
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Smiles:
O=C(C1CC1(F)C(=O)O)OCc1ccccc1
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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Smiles: O=C(OC(C)(C)C)NCCc1ccc(cc1)NC(=O)OC(C)(C)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
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Xlogp3: __
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MolecularFormula:
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MdlNumber:
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Smiles:
O=C(OC(C)(C)C)NCCc1ccc(cc1)NC(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
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Smiles: C=CCNC(=S)NNC(=O)COc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
C=CCNC(=S)NNC(=O)COc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__