AA12543
1138324-48-7 | (2S,4R)-1-(tert-Butoxycarbonyl)-4-fluoro-2-hydroxymethylpyrrolidine
Manufacturer: A2B Chem
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CatalogNumber
AA12543
ChemicalName
(2S,4R)-1-(tert-Butoxycarbonyl)-4-fluoro-2-hydroxymethylpyrrolidine
CasNumber
1138324-48-7
MolecularFormula
C10H18FNO3
MolecularWeight
219.2532
MdlNumber
MFCD22573266
Smiles
OC[C@@H]1C[C@H](CN1C(=O)OC(C)(C)C)F
Complexity
239
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
2
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1
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CatalogNumber: AA12543
ChemicalName: (2S,4R)-1-(tert-Butoxycarbonyl)-4-fluoro-2-hydroxymethylpyrrolidine
CasNumber: 1138324-48-7
MolecularFormula: C10H18FNO3
MolecularWeight: 219.2532
MdlNumber: MFCD22573266
Smiles: OC[C@@H]1C[C@H](CN1C(=O)OC(C)(C)C)F
Complexity: 239
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1
CatalogNumber:
AA12543
ChemicalName:
(2S,4R)-1-(tert-Butoxycarbonyl)-4-fluoro-2-hydroxymethylpyrrolidine
CasNumber:
1138324-48-7
MolecularFormula:
C10H18FNO3
MolecularWeight:
219.2532
MdlNumber:
MFCD22573266
Smiles:
OC[C@@H]1C[C@H](CN1C(=O)OC(C)(C)C)F
Complexity:
239
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NC[C@@H]1C[C@H](CN1C(=O)OC(C)(C)C)F
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NC[C@@H]1C[C@H](CN1C(=O)OC(C)(C)C)F
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA12545
ChemicalName: (R)-2-((((Benzyloxy)carbonyl)amino)methyl)-3-methylbutanoic acid
CasNumber: 1138323-75-7
MolecularFormula: C14H19NO4
MolecularWeight: 265.305
MdlNumber: MFCD18433300
Smiles: CC([C@@H](C(=O)O)CNC(=O)OCc1ccccc1)C
Complexity: 298
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 7
Xlogp3: 2.3
CatalogNumber:
AA12545
ChemicalName:
(R)-2-((((Benzyloxy)carbonyl)amino)methyl)-3-methylbutanoic acid
CasNumber:
1138323-75-7
MolecularFormula:
C14H19NO4
MolecularWeight:
265.305
MdlNumber:
MFCD18433300
Smiles:
CC([C@@H](C(=O)O)CNC(=O)OCc1ccccc1)C
Complexity:
298
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
7
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-]C(=O)OC.CC[N+](CC)(CC)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-]C(=O)OC.CC[N+](CC)(CC)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__