AA89864
1676-73-9 | H-Glu(OBzl)-OH
Manufacturer: A2B Chem
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CatalogNumber
AA89864
ChemicalName
H-Glu(OBzl)-OH
CasNumber
1676-73-9
MolecularFormula
C12H14NO4
MolecularWeight
236.2439
MdlNumber
MFCD00002633
Smiles
O=C(OCc1ccccc1)CC[C@@H](C(=O)[O-])N
Complexity
261
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
7
Xlogp3
-1.7
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CatalogNumber: AA89864
ChemicalName: H-Glu(OBzl)-OH
CasNumber: 1676-73-9
MolecularFormula: C12H14NO4
MolecularWeight: 236.2439
MdlNumber: MFCD00002633
Smiles: O=C(OCc1ccccc1)CC[C@@H](C(=O)[O-])N
Complexity: 261
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 7
Xlogp3: -1.7
CatalogNumber:
AA89864
ChemicalName:
H-Glu(OBzl)-OH
CasNumber:
1676-73-9
MolecularFormula:
C12H14NO4
MolecularWeight:
236.2439
MdlNumber:
MFCD00002633
Smiles:
O=C(OCc1ccccc1)CC[C@@H](C(=O)[O-])N
Complexity:
261
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
7
Xlogp3:
-1.7
CatalogNumber: AA89865
ChemicalName: 4'-Ethoxyacetophenone
CasNumber: 1676-63-7
MolecularFormula: C10H12O2
MolecularWeight: 164.2011
MdlNumber: MFCD00009095
Smiles: CCOc1ccc(cc1)C(=O)C
Complexity: 146
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: 2.1
CatalogNumber:
AA89865
ChemicalName:
4'-Ethoxyacetophenone
CasNumber:
1676-63-7
MolecularFormula:
C10H12O2
MolecularWeight:
164.2011
MdlNumber:
MFCD00009095
Smiles:
CCOc1ccc(cc1)C(=O)C
Complexity:
146
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCC=C(C=Cc1c(C)cc(c(c1C)C)OC)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCC=C(C=Cc1c(C)cc(c(c1C)C)OC)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)C=C(C=Cc1c(C)cc(c(c1C)C)OC)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)C=C(C=Cc1c(C)cc(c(c1C)C)OC)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__