AD70526
1031927-14-6 | tert-Butyl 1,9-diazaspiro[5.5]undecane-9-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AD70526
ChemicalName
tert-Butyl 1,9-diazaspiro[5.5]undecane-9-carboxylate
CasNumber
1031927-14-6
MolecularFormula
C14H26N2O2
MolecularWeight
254.3684
MdlNumber
MFCD09998745
Smiles
O=C(N1CCC2(CC1)CCCCN2)OC(C)(C)C
Complexity
301
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.9
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CatalogNumber: AD70526
ChemicalName: tert-Butyl 1,9-diazaspiro[5.5]undecane-9-carboxylate
CasNumber: 1031927-14-6
MolecularFormula: C14H26N2O2
MolecularWeight: 254.3684
MdlNumber: MFCD09998745
Smiles: O=C(N1CCC2(CC1)CCCCN2)OC(C)(C)C
Complexity: 301
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.9
CatalogNumber:
AD70526
ChemicalName:
tert-Butyl 1,9-diazaspiro[5.5]undecane-9-carboxylate
CasNumber:
1031927-14-6
MolecularFormula:
C14H26N2O2
MolecularWeight:
254.3684
MdlNumber:
MFCD09998745
Smiles:
O=C(N1CCC2(CC1)CCCCN2)OC(C)(C)C
Complexity:
301
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.9
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Smiles: N#CC1(NC(=O)OC(C)(C)C)CC1(F)F
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N#CC1(NC(=O)OC(C)(C)C)CC1(F)F
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Smiles: O=POC1C(COP(=O)(OP(=O)(OCC(C)C)O)O)OC(C1O)n1cnc2c1ncnc2N.[Li]
Complexity: __
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Smiles:
O=POC1C(COP(=O)(OP(=O)(OCC(C)C)O)O)OC(C1O)n1cnc2c1ncnc2N.[Li]
Complexity:
__
Covalently-bondedUnitCount:
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RotatableBondCount:
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Smiles: O=C(/C=C/c1ccc(c(c1)O)O)NCCc1ccc(c(c1)O)O
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
O=C(/C=C/c1ccc(c(c1)O)O)NCCc1ccc(c(c1)O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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