AX13581
1823822-36-1 | tert-Butyl 2-hydroxy-9-azabicyclo[3.3.1]nonane-9-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AX13581
ChemicalName
tert-Butyl 2-hydroxy-9-azabicyclo[3.3.1]nonane-9-carboxylate
CasNumber
1823822-36-1
MolecularFormula
C13H23NO3
MolecularWeight
241.3266
MdlNumber
MFCD27997340
Smiles
OC1CCC2N(C1CCC2)C(=O)OC(C)(C)C
Complexity
298
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
UndefinedAtomStereocenterCount
3
Xlogp3
2
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CatalogNumber: AX13581
ChemicalName: tert-Butyl 2-hydroxy-9-azabicyclo[3.3.1]nonane-9-carboxylate
CasNumber: 1823822-36-1
MolecularFormula: C13H23NO3
MolecularWeight: 241.3266
MdlNumber: MFCD27997340
Smiles: OC1CCC2N(C1CCC2)C(=O)OC(C)(C)C
Complexity: 298
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 3
Xlogp3: 2
CatalogNumber:
AX13581
ChemicalName:
tert-Butyl 2-hydroxy-9-azabicyclo[3.3.1]nonane-9-carboxylate
CasNumber:
1823822-36-1
MolecularFormula:
C13H23NO3
MolecularWeight:
241.3266
MdlNumber:
MFCD27997340
Smiles:
OC1CCC2N(C1CCC2)C(=O)OC(C)(C)C
Complexity:
298
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
3
Xlogp3:
2
CatalogNumber: __
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Smiles: Cn1cnc(c1C1CCNCC1)c1ccccc1
Complexity: __
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Smiles:
Cn1cnc(c1C1CCNCC1)c1ccccc1
Complexity:
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Smiles: OCCOc1ncc(cc1Cl)C(F)(F)F
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Smiles:
OCCOc1ncc(cc1Cl)C(F)(F)F
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HydrogenBondAcceptorCount:
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Smiles: CCOC(=O)c1[nH]c2c(c1)cc(c(c2)F)Cl
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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RotatableBondCount: __
UndefinedAtomStereocenterCount: __
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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:
CCOC(=O)c1[nH]c2c(c1)cc(c(c2)F)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__