AI16258
1251002-30-8 | tert-Butyl 3-(hydroxymethyl)-2-oxa-7-azaspiro[4.5]decane-7-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI16258
ChemicalName
tert-Butyl 3-(hydroxymethyl)-2-oxa-7-azaspiro[4.5]decane-7-carboxylate
CasNumber
1251002-30-8
MolecularFormula
C14H25NO4
MolecularWeight
271.3526
MdlNumber
MFCD15530243
Smiles
OCC1OCC2(C1)CCCN(C2)C(=O)OC(C)(C)C
Complexity
339
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
UndefinedAtomStereocenterCount
2
Xlogp3
1.1
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CatalogNumber: AI16258
ChemicalName: tert-Butyl 3-(hydroxymethyl)-2-oxa-7-azaspiro[4.5]decane-7-carboxylate
CasNumber: 1251002-30-8
MolecularFormula: C14H25NO4
MolecularWeight: 271.3526
MdlNumber: MFCD15530243
Smiles: OCC1OCC2(C1)CCCN(C2)C(=O)OC(C)(C)C
Complexity: 339
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 2
Xlogp3: 1.1
CatalogNumber:
AI16258
ChemicalName:
tert-Butyl 3-(hydroxymethyl)-2-oxa-7-azaspiro[4.5]decane-7-carboxylate
CasNumber:
1251002-30-8
MolecularFormula:
C14H25NO4
MolecularWeight:
271.3526
MdlNumber:
MFCD15530243
Smiles:
OCC1OCC2(C1)CCCN(C2)C(=O)OC(C)(C)C
Complexity:
339
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
2
Xlogp3:
1.1
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Smiles: CC(C)(C)OC(=O)N1CC2=CC=CC=C2C3C1CNC3
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CC(C)(C)OC(=O)N1CC2=CC=CC=C2C3C1CNC3
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Smiles: O=C(N1CCn2c(C1)c(nn2)C(=O)O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(N1CCn2c(C1)c(nn2)C(=O)O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__