AA91648
173405-78-2 | tert-Butyl 3,9-diazaspiro[5.5]undecane-3-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA91648
ChemicalName
tert-Butyl 3,9-diazaspiro[5.5]undecane-3-carboxylate
CasNumber
173405-78-2
MolecularFormula
C14H26N2O2
MolecularWeight
254.3684
MdlNumber
MFCD05861627
Smiles
O=C(N1CCC2(CC1)CCNCC2)OC(C)(C)C
Complexity
293
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.8
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CatalogNumber: AA91648
ChemicalName: tert-Butyl 3,9-diazaspiro[5.5]undecane-3-carboxylate
CasNumber: 173405-78-2
MolecularFormula: C14H26N2O2
MolecularWeight: 254.3684
MdlNumber: MFCD05861627
Smiles: O=C(N1CCC2(CC1)CCNCC2)OC(C)(C)C
Complexity: 293
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.8
CatalogNumber:
AA91648
ChemicalName:
tert-Butyl 3,9-diazaspiro[5.5]undecane-3-carboxylate
CasNumber:
173405-78-2
MolecularFormula:
C14H26N2O2
MolecularWeight:
254.3684
MdlNumber:
MFCD05861627
Smiles:
O=C(N1CCC2(CC1)CCNCC2)OC(C)(C)C
Complexity:
293
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: COCCCOc1cc(ccc1OC)C[C@H](C(C)C)C[C@@H]([C@H](C[C@H](C(=O)NCC(C(=O)N)(C)C)C(C)C)O)N.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
COCCCOc1cc(ccc1OC)C[C@H](C(C)C)C[C@@H]([C@H](C[C@H](C(=O)NCC(C(=O)N)(C)C)C(C)C)O)N.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: ClC(=O)OCC(Cl)(Cl)Cl
Complexity: 107
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3
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MolecularFormula:
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MolecularWeight:
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Smiles:
ClC(=O)OCC(Cl)(Cl)Cl
Complexity:
107
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3
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Smiles: CS(=O)(=O)c1cnnc2c1cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
CS(=O)(=O)c1cnnc2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__