AB77205
95656-88-5 | Benzyl 3-hydroxypyrrolidine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB77205
ChemicalName
Benzyl 3-hydroxypyrrolidine-1-carboxylate
CasNumber
95656-88-5
MolecularFormula
C12H15NO3
MolecularWeight
221.2524
MdlNumber
MFCD08061949
Smiles
OC1CCN(C1)C(=O)OCc1ccccc1
Complexity
238
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
UndefinedAtomStereocenterCount
1
Xlogp3
1.1
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CatalogNumber: AB77205
ChemicalName: Benzyl 3-hydroxypyrrolidine-1-carboxylate
CasNumber: 95656-88-5
MolecularFormula: C12H15NO3
MolecularWeight: 221.2524
MdlNumber: MFCD08061949
Smiles: OC1CCN(C1)C(=O)OCc1ccccc1
Complexity: 238
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.1
CatalogNumber:
AB77205
ChemicalName:
Benzyl 3-hydroxypyrrolidine-1-carboxylate
CasNumber:
95656-88-5
MolecularFormula:
C12H15NO3
MolecularWeight:
221.2524
MdlNumber:
MFCD08061949
Smiles:
OC1CCN(C1)C(=O)OCc1ccccc1
Complexity:
238
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)CC1CCCN(C1)C(=O)OCc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)CC1CCCN(C1)C(=O)OCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AB77207
ChemicalName: (4-Oxocyclohexyl)carbamic acid benzyl ester
CasNumber: 16801-63-1
MolecularFormula: C14H17NO3
MolecularWeight: 247.2897
MdlNumber: MFCD06658393
Smiles: O=C(NC1CCC(=O)CC1)OCc1ccccc1
Complexity: 287
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 4
UndefinedAtomStereocenterCount: __
Xlogp3: 1.7
CatalogNumber:
AB77207
ChemicalName:
(4-Oxocyclohexyl)carbamic acid benzyl ester
CasNumber:
16801-63-1
MolecularFormula:
C14H17NO3
MolecularWeight:
247.2897
MdlNumber:
MFCD06658393
Smiles:
O=C(NC1CCC(=O)CC1)OCc1ccccc1
Complexity:
287
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
__
Xlogp3:
1.7
CatalogNumber: AB77208
ChemicalName: N-Cbz-4-amino-cyclohexanol
CasNumber: 16801-62-0
MolecularFormula: C14H19NO3
MolecularWeight: 249.3056
MdlNumber: MFCD02728352
Smiles: OC1CCC(CC1)NC(=O)OCc1ccccc1
Complexity: 256
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 4
UndefinedAtomStereocenterCount: __
Xlogp3: 2.1
CatalogNumber:
AB77208
ChemicalName:
N-Cbz-4-amino-cyclohexanol
CasNumber:
16801-62-0
MolecularFormula:
C14H19NO3
MolecularWeight:
249.3056
MdlNumber:
MFCD02728352
Smiles:
OC1CCC(CC1)NC(=O)OCc1ccccc1
Complexity:
256
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
__
Xlogp3:
2.1