AA29782
1250998-93-6 | tert-Butyl 3-(iodomethyl)-2-oxa-8-azaspiro[4.5]decane-8-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA29782
ChemicalName
tert-Butyl 3-(iodomethyl)-2-oxa-8-azaspiro[4.5]decane-8-carboxylate
CasNumber
1250998-93-6
MolecularFormula
C14H24INO3
MolecularWeight
381.2497
MdlNumber
MFCD15530221
Smiles
ICC1OCC2(C1)CCN(CC2)C(=O)OC(C)(C)C
Complexity
332
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
3
RotatableBondCount
3
UndefinedAtomStereocenterCount
1
Xlogp3
2.9
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CatalogNumber: AA29782
ChemicalName: tert-Butyl 3-(iodomethyl)-2-oxa-8-azaspiro[4.5]decane-8-carboxylate
CasNumber: 1250998-93-6
MolecularFormula: C14H24INO3
MolecularWeight: 381.2497
MdlNumber: MFCD15530221
Smiles: ICC1OCC2(C1)CCN(CC2)C(=O)OC(C)(C)C
Complexity: 332
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.9
CatalogNumber:
AA29782
ChemicalName:
tert-Butyl 3-(iodomethyl)-2-oxa-8-azaspiro[4.5]decane-8-carboxylate
CasNumber:
1250998-93-6
MolecularFormula:
C14H24INO3
MolecularWeight:
381.2497
MdlNumber:
MFCD15530221
Smiles:
ICC1OCC2(C1)CCN(CC2)C(=O)OC(C)(C)C
Complexity:
332
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.9
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Smiles: O=C(N1CC2CCC(C1)C2C(=O)O)OC(C)(C)C
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Smiles:
O=C(N1CC2CCC(C1)C2C(=O)O)OC(C)(C)C
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Smiles: [O-]C(=O)C1CC2CCC1N(C2)C(=O)OC(C)(C)C
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Smiles:
[O-]C(=O)C1CC2CCC1N(C2)C(=O)OC(C)(C)C
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Smiles: CCOC(=O)c1cnc2n1cc(Cl)nc2
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Smiles:
CCOC(=O)c1cnc2n1cc(Cl)nc2
Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
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