AI35853
1445950-79-7 | tert-Butyl 9-(hydroxymethyl)-8-oxo-2,7-diazaspiro[4.4]nonane-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI35853
ChemicalName
tert-Butyl 9-(hydroxymethyl)-8-oxo-2,7-diazaspiro[4.4]nonane-2-carboxylate
CasNumber
1445950-79-7
MolecularFormula
C13H22N2O4
MolecularWeight
270.3248
MdlNumber
MFCD25509370
Smiles
OCC1C(=O)NCC21CCN(C2)C(=O)OC(C)(C)C
Complexity
391
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
3
UndefinedAtomStereocenterCount
2
Xlogp3
0.3
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CatalogNumber: AI35853
ChemicalName: tert-Butyl 9-(hydroxymethyl)-8-oxo-2,7-diazaspiro[4.4]nonane-2-carboxylate
CasNumber: 1445950-79-7
MolecularFormula: C13H22N2O4
MolecularWeight: 270.3248
MdlNumber: MFCD25509370
Smiles: OCC1C(=O)NCC21CCN(C2)C(=O)OC(C)(C)C
Complexity: 391
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 2
Xlogp3: 0.3
CatalogNumber:
AI35853
ChemicalName:
tert-Butyl 9-(hydroxymethyl)-8-oxo-2,7-diazaspiro[4.4]nonane-2-carboxylate
CasNumber:
1445950-79-7
MolecularFormula:
C13H22N2O4
MolecularWeight:
270.3248
MdlNumber:
MFCD25509370
Smiles:
OCC1C(=O)NCC21CCN(C2)C(=O)OC(C)(C)C
Complexity:
391
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
2
Xlogp3:
0.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1cn(c(c1)C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1cn(c(c1)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCC1CN(Cc2c1n(C)cn2)C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCC1CN(Cc2c1n(C)cn2)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AI35856
ChemicalName: 2-tert-Butyl 5-methyl 7-oxa-2-azaspiro[3.5]nonane-2,5-dicarboxylate
CasNumber: 1445950-84-4
MolecularFormula: C14H23NO5
MolecularWeight: 285.3361
MdlNumber: MFCD25509378
Smiles: COC(=O)C1COCCC21CN(C2)C(=O)OC(C)(C)C
Complexity: 395
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: __
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.8
CatalogNumber:
AI35856
ChemicalName:
2-tert-Butyl 5-methyl 7-oxa-2-azaspiro[3.5]nonane-2,5-dicarboxylate
CasNumber:
1445950-84-4
MolecularFormula:
C14H23NO5
MolecularWeight:
285.3361
MdlNumber:
MFCD25509378
Smiles:
COC(=O)C1COCCC21CN(C2)C(=O)OC(C)(C)C
Complexity:
395
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
__
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.8