AB96834
885268-42-8 | tert-Butyl 2,7-diazaspiro[4.5]decane-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB96834
ChemicalName
tert-Butyl 2,7-diazaspiro[4.5]decane-2-carboxylate
CasNumber
885268-42-8
MolecularFormula
C13H24N2O2
MolecularWeight
240.34186000000008
MdlNumber
MFCD08234437
Smiles
O=C(N1CCC2(C1)CCCNC2)OC(C)(C)C
Complexity
298
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
1.4
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CatalogNumber: AB96834
ChemicalName: tert-Butyl 2,7-diazaspiro[4.5]decane-2-carboxylate
CasNumber: 885268-42-8
MolecularFormula: C13H24N2O2
MolecularWeight: 240.34186000000008
MdlNumber: MFCD08234437
Smiles: O=C(N1CCC2(C1)CCCNC2)OC(C)(C)C
Complexity: 298
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.4
CatalogNumber:
AB96834
ChemicalName:
tert-Butyl 2,7-diazaspiro[4.5]decane-2-carboxylate
CasNumber:
885268-42-8
MolecularFormula:
C13H24N2O2
MolecularWeight:
240.34186000000008
MdlNumber:
MFCD08234437
Smiles:
O=C(N1CCC2(C1)CCCNC2)OC(C)(C)C
Complexity:
298
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.4
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Smiles: OC(=O)c1cc(ccc1N)c1cccs1
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Smiles:
OC(=O)c1cc(ccc1N)c1cccs1
Complexity:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
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Smiles: CC(/C=C(/C1(N)CC1)C)C
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RotatableBondCount: __
UndefinedAtomStereocenterCount: __
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Smiles:
CC(/C=C(/C1(N)CC1)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC/C=C(/C1(N)CC1)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC/C=C(/C1(N)CC1)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__