3-Carboxy-O-ethyltyrosine--hydrogen chloride (1/1)
Basic information
- CAS
16220-80-7- Standard SMILES
CCOc1ccc(CC(N)C(=O)O)cc1C(=O)O.Cl- InChIKey
IAUWSJUHASZAQT-UHFFFAOYSA-N- Molecular formula
- C12H16ClNO5
- Average molar mass
- 289.71 g/mol
- Monoisotopic mass
- 289.0717003
Names & identifiers
- Preferred name
- 3-Carboxy-O-ethyltyrosine--hydrogen chloride (1/1)
- IUPAC
- 5-(2-amino-2-carboxyethyl)-2-ethoxybenzoic acid;hydrochloride
Names & synonyms
16220-80-7DTXSID609366543-Carboxy-O-ethyltyrosine--hydrogen chloride (1/1)RefChem:1067539DTXCID301365254DL-alpha-Amino-3-carboxy-4-ethoxyhydrocinnamic acid hydrochlorideHydrocinnamic acid, alpha-amino-3-carboxy-4-ethoxy-, hydrochloride, DL-
Database identifiers
- CAS
16220-80-7- PubChem CID
- 64826
- DTXSID
DTXSID60936654
Properties
Computed structural properties
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 307
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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