AA68417
14173-40-1 | 4-Chloro-DL-phenylalanine methyl ester, HCl
Manufacturer: A2B Chem
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CatalogNumber
AA68417
ChemicalName
4-Chloro-DL-phenylalanine methyl ester, HCl
CasNumber
14173-40-1
MolecularFormula
C10H13Cl2NO2
MolecularWeight
250.1217
MdlNumber
MFCD00012530
Smiles
COC(=O)[C@H](Cc1ccc(cc1)Cl)N.Cl
Complexity
191
Covalently-bondedUnitCount
2
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
4
UndefinedAtomStereocenterCount
1
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CatalogNumber: AA68417
ChemicalName: 4-Chloro-DL-phenylalanine methyl ester, HCl
CasNumber: 14173-40-1
MolecularFormula: C10H13Cl2NO2
MolecularWeight: 250.1217
MdlNumber: MFCD00012530
Smiles: COC(=O)[C@H](Cc1ccc(cc1)Cl)N.Cl
Complexity: 191
Covalently-bondedUnitCount: 2
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 1
CatalogNumber:
AA68417
ChemicalName:
4-Chloro-DL-phenylalanine methyl ester, HCl
CasNumber:
14173-40-1
MolecularFormula:
C10H13Cl2NO2
MolecularWeight:
250.1217
MdlNumber:
MFCD00012530
Smiles:
COC(=O)[C@H](Cc1ccc(cc1)Cl)N.Cl
Complexity:
191
Covalently-bondedUnitCount:
2
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N[C@H](C(=O)O)Cc1ccc(cc1)Cl
Complexity: 179
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N[C@H](C(=O)O)Cc1ccc(cc1)Cl
Complexity:
179
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCc1ncccc1O.Cl
Complexity: 87.1
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCc1ncccc1O.Cl
Complexity:
87.1
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CSSc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CSSc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__