AB17769
207405-59-2 | tert-Butyl 6-hydroxy-2-aza-bicyclo[2.2.1]heptane-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB17769
ChemicalName
tert-Butyl 6-hydroxy-2-aza-bicyclo[2.2.1]heptane-2-carboxylate
CasNumber
207405-59-2
MolecularFormula
C11H19NO3
MolecularWeight
213.2735
MdlNumber
MFCD20278316
Smiles
OC1CC2CC1N(C2)C(=O)OC(C)(C)C
Complexity
272
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
UndefinedAtomStereocenterCount
3
Xlogp3
1.1
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CatalogNumber: AB17769
ChemicalName: tert-Butyl 6-hydroxy-2-aza-bicyclo[2.2.1]heptane-2-carboxylate
CasNumber: 207405-59-2
MolecularFormula: C11H19NO3
MolecularWeight: 213.2735
MdlNumber: MFCD20278316
Smiles: OC1CC2CC1N(C2)C(=O)OC(C)(C)C
Complexity: 272
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 3
Xlogp3: 1.1
CatalogNumber:
AB17769
ChemicalName:
tert-Butyl 6-hydroxy-2-aza-bicyclo[2.2.1]heptane-2-carboxylate
CasNumber:
207405-59-2
MolecularFormula:
C11H19NO3
MolecularWeight:
213.2735
MdlNumber:
MFCD20278316
Smiles:
OC1CC2CC1N(C2)C(=O)OC(C)(C)C
Complexity:
272
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
3
Xlogp3:
1.1
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Smiles: NCCNCCNC(C)C
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NCCNCCNC(C)C
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Smiles: CC(C1CC(=O)CC(=O)C1)C.O
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Smiles:
CC(C1CC(=O)CC(=O)C1)C.O
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: O=C1Nc2c(C1=O)cc(cc2)S(=O)(=O)[O-].[Na+].O.O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1Nc2c(C1=O)cc(cc2)S(=O)(=O)[O-].[Na+].O.O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__