AI66992
1221818-31-0 | tert-Butyl 7-hydroxy-2-azabicyclo[2.2.1]heptane-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI66992
ChemicalName
tert-Butyl 7-hydroxy-2-azabicyclo[2.2.1]heptane-2-carboxylate
CasNumber
1221818-31-0
MolecularFormula
C11H19NO3
MolecularWeight
213.27346000000009
MdlNumber
MFCD18792130
Smiles
OC1C2CCC1N(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: AI66992
ChemicalName: tert-Butyl 7-hydroxy-2-azabicyclo[2.2.1]heptane-2-carboxylate
CasNumber: 1221818-31-0
MolecularFormula: C11H19NO3
MolecularWeight: 213.27346000000009
MdlNumber: MFCD18792130
Smiles: OC1C2CCC1N(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:
AI66992
ChemicalName:
tert-Butyl 7-hydroxy-2-azabicyclo[2.2.1]heptane-2-carboxylate
CasNumber:
1221818-31-0
MolecularFormula:
C11H19NO3
MolecularWeight:
213.27346000000009
MdlNumber:
MFCD18792130
Smiles:
OC1C2CCC1N(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: __
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MolecularFormula: __
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MdlNumber: __
Smiles: CCOC(=O)[C@H]1CC[C@@H]([C@H](C1)O)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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RotatableBondCount: __
UndefinedAtomStereocenterCount: __
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Smiles:
CCOC(=O)[C@H]1CC[C@@H]([C@H](C1)O)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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Smiles: O=C(N1CC(C1)B1OC(C(O1)(C)C)(C)C)OC(C)(C)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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UndefinedAtomStereocenterCount: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
O=C(N1CC(C1)B1OC(C(O1)(C)C)(C)C)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)CCc1cnc2c(c1F)ccn2[Si](C(C)C)(C(C)C)C(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)CCc1cnc2c(c1F)ccn2[Si](C(C)C)(C(C)C)C(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__