AA28919
124605-42-1 | Methyl (2r,3s)-3-(tert-butoxycarbonylamino)-2-hydroxy-3-phenylpropionate
Manufacturer: A2B Chem
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CatalogNumber
AA28919
ChemicalName
Methyl (2r,3s)-3-(tert-butoxycarbonylamino)-2-hydroxy-3-phenylpropionate
CasNumber
124605-42-1
MolecularFormula
C15H21NO5
MolecularWeight
295.33094
MdlNumber
MFCD09037385
Smiles
COC(=O)[C@@H]([C@H](c1ccccc1)NC(=O)OC(C)(C)C)O
Complexity
358
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
2
HeavyAtomCount
21
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
7
Xlogp3
1.7
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CatalogNumber: AA28919
ChemicalName: Methyl (2r,3s)-3-(tert-butoxycarbonylamino)-2-hydroxy-3-phenylpropionate
CasNumber: 124605-42-1
MolecularFormula: C15H21NO5
MolecularWeight: 295.33094
MdlNumber: MFCD09037385
Smiles: COC(=O)[C@@H]([C@H](c1ccccc1)NC(=O)OC(C)(C)C)O
Complexity: 358
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 7
Xlogp3: 1.7
CatalogNumber:
AA28919
ChemicalName:
Methyl (2r,3s)-3-(tert-butoxycarbonylamino)-2-hydroxy-3-phenylpropionate
CasNumber:
124605-42-1
MolecularFormula:
C15H21NO5
MolecularWeight:
295.33094
MdlNumber:
MFCD09037385
Smiles:
COC(=O)[C@@H]([C@H](c1ccccc1)NC(=O)OC(C)(C)C)O
Complexity:
358
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
7
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#CCc1cc(ccc1OCc1ccccc1)C(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#CCc1cc(ccc1OCc1ccccc1)C(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA28923
ChemicalName: (2-(Benzyloxy)-5-(tert-butyl)phenyl)methanol
CasNumber: 1246213-25-1
MolecularFormula: C18H22O2
MolecularWeight: 270.3661
MdlNumber: MFCD26393884
Smiles: OCc1cc(ccc1OCc1ccccc1)C(C)(C)C
Complexity: 276
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 4.3
CatalogNumber:
AA28923
ChemicalName:
(2-(Benzyloxy)-5-(tert-butyl)phenyl)methanol
CasNumber:
1246213-25-1
MolecularFormula:
C18H22O2
MolecularWeight:
270.3661
MdlNumber:
MFCD26393884
Smiles:
OCc1cc(ccc1OCc1ccccc1)C(C)(C)C
Complexity:
276
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
4.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)C(c1cc(c(cc1O)NC(=O)c1c[nH]c2c(c1=O)cccc2)C(C)(C)C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)C(c1cc(c(cc1O)NC(=O)c1c[nH]c2c(c1=O)cccc2)C(C)(C)C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__