AB54937
483366-12-7 | (2S,4R)-1-Boc-2-cyano-4-hydroxypyrrolidine
Manufacturer: A2B Chem
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CatalogNumber
AB54937
ChemicalName
(2S,4R)-1-Boc-2-cyano-4-hydroxypyrrolidine
CasNumber
483366-12-7
MolecularFormula
C10H16N2O3
MolecularWeight
212.2456
MdlNumber
MFCD09863132
Smiles
O[C@@H]1C[C@H](N(C1)C(=O)OC(C)(C)C)C#N
Complexity
300
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
2
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
0.4
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CatalogNumber: AB54937
ChemicalName: (2S,4R)-1-Boc-2-cyano-4-hydroxypyrrolidine
CasNumber: 483366-12-7
MolecularFormula: C10H16N2O3
MolecularWeight: 212.2456
MdlNumber: MFCD09863132
Smiles: O[C@@H]1C[C@H](N(C1)C(=O)OC(C)(C)C)C#N
Complexity: 300
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 0.4
CatalogNumber:
AB54937
ChemicalName:
(2S,4R)-1-Boc-2-cyano-4-hydroxypyrrolidine
CasNumber:
483366-12-7
MolecularFormula:
C10H16N2O3
MolecularWeight:
212.2456
MdlNumber:
MFCD09863132
Smiles:
O[C@@H]1C[C@H](N(C1)C(=O)OC(C)(C)C)C#N
Complexity:
300
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
0.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC[C@@H]1C[C@H](CN1C(=O)OC(C)(C)C)O[Si](C(C)(C)C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC[C@@H]1C[C@H](CN1C(=O)OC(C)(C)C)O[Si](C(C)(C)C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB54939
ChemicalName: (2S,4R)-4-Fluoropyrrolidine-2-carboxamide hydrochloride
CasNumber: 796884-06-5
MolecularFormula: C5H10ClFN2O
MolecularWeight: 168.5971
MdlNumber: MFCD21608685
Smiles: NC(=O)[C@@H]1C[C@H](CN1)F.Cl
Complexity: 128
Covalently-bondedUnitCount: 2
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AB54939
ChemicalName:
(2S,4R)-4-Fluoropyrrolidine-2-carboxamide hydrochloride
CasNumber:
796884-06-5
MolecularFormula:
C5H10ClFN2O
MolecularWeight:
168.5971
MdlNumber:
MFCD21608685
Smiles:
NC(=O)[C@@H]1C[C@H](CN1)F.Cl
Complexity:
128
Covalently-bondedUnitCount:
2
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
1
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NC(=O)[C@@H]1C[C@H](CN1)O.Cl
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NC(=O)[C@@H]1C[C@H](CN1)O.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__