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Methyl 3-amino-2-hydroxy-4-phenylbutanoate

HCID 5239179
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COC(=O)C(O)C(N)Cc1ccccc1
InChIKey
LAHWVQFOBUUDBA-UHFFFAOYSA-N
Molecular formula
C11H15NO3
Average molar mass
209.24 g/mol

Names & identifiers

Preferred name
Methyl 3-amino-2-hydroxy-4-phenylbutanoate
IUPAC
methyl 3-amino-2-hydroxy-4-phenylbutanoate

Names & synonyms

methyl 3-amino-2-hydroxy-4-phenylbutanoate123206-29-1SCHEMBL7964846AKOS015382470

Database identifiers

PubChem CID
5239179

Properties

Computed structural properties

XLogP
0.6
Topological polar surface area
72.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
15
Formal charge
0
Complexity
202

Related reactions

3 records
New reaction record
HRID 117211 reaction equation
HRID 117211As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 1119557 reaction equation
HRID 1119557As reactantTraining data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID 1571112 reaction equation
HRID 1571112As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)

Compound notes

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