2,5-Dimethoxy-4-methylphenylalanine
Basic information
- CAS
33172-02-0- Standard SMILES
COc1cc(CC(N)C(=O)O)c(OC)cc1C- InChIKey
MWCDQZBPLTYYSP-UHFFFAOYSA-N- Molecular formula
- C12H17NO4
- Average molar mass
- 239.27 g/mol
- Monoisotopic mass
- 239.11575802
Overview
RN given refers to parent cpd; structure
Names & identifiers
- Preferred name
- 2,5-Dimethoxy-4-methylphenylalanine
- IUPAC
- 2-amino-3-(2,5-dimethoxy-4-methylphenyl)propanoic acid
Names & synonyms
2,5-Dimethoxy-4-methylphenylalanine33172-02-0RefChem:82898Phenylalanine, 2,5-dimethoxy-4-methyl-2-amino-3-(2,5-dimethoxy-4-methylphenyl)propanoic acidSCHEMBL5325670DTXSID209547982,5-Dimethoxy-4-methylphenylalaninato
Database identifiers
- CAS
33172-02-0- PubChem CID
- 3015652
- DTXSID
DTXSID20954798
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 81.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 259
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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