AE79642
1251010-99-7 | tert-Butyl 1,8-dioxa-4,11-diazaspiro[5.6]dodecane-11-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AE79642
ChemicalName
tert-Butyl 1,8-dioxa-4,11-diazaspiro[5.6]dodecane-11-carboxylate
CasNumber
1251010-99-7
MolecularFormula
C13H24N2O4
MolecularWeight
272.34066
MdlNumber
MFCD14581088
Smiles
O=C(N1CCOCC2(C1)CNCCO2)OC(C)(C)C
Complexity
329
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
-0.2
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CatalogNumber: AE79642
ChemicalName: tert-Butyl 1,8-dioxa-4,11-diazaspiro[5.6]dodecane-11-carboxylate
CasNumber: 1251010-99-7
MolecularFormula: C13H24N2O4
MolecularWeight: 272.34066
MdlNumber: MFCD14581088
Smiles: O=C(N1CCOCC2(C1)CNCCO2)OC(C)(C)C
Complexity: 329
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: -0.2
CatalogNumber:
AE79642
ChemicalName:
tert-Butyl 1,8-dioxa-4,11-diazaspiro[5.6]dodecane-11-carboxylate
CasNumber:
1251010-99-7
MolecularFormula:
C13H24N2O4
MolecularWeight:
272.34066
MdlNumber:
MFCD14581088
Smiles:
O=C(N1CCOCC2(C1)CNCCO2)OC(C)(C)C
Complexity:
329
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
-0.2
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Smiles: FC(Oc1cccc2c1nccc2)(F)F
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Smiles:
FC(Oc1cccc2c1nccc2)(F)F
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Smiles: COC(=O)/C(=C/C1CCCC1)/c1ccc(cc1)S(=O)(=O)C
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
COC(=O)/C(=C/C1CCCC1)/c1ccc(cc1)S(=O)(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
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