Basic information
- CAS
6519-66-0- Standard SMILES
CCOC(=O)C(N)Cc1c[nH]c2ccccc12- InChIKey
DABYEOZXRSTEGL-UHFFFAOYSA-N- Molecular formula
- C13H16N2O2
- Average molar mass
- 232.28 g/mol
Names & identifiers
- Preferred name
- Ethyl DL-tryptophanate
- IUPAC
- ethyl 2-amino-3-(1H-indol-3-yl)propanoate
Names & synonyms
Ethyl DL-tryptophanateU4U6385NKLRefChem:1085036Ethyl 2-amino-3-(1H-indol-3-yl)propanoate6519-66-0ethyl tryptophanateDL-Tryptophan, ethyl esterdl-Tryptophan ethyl esterEthyl 2-amino-3-(1H-indol-3-yl)propanoate #TRYPTOPHANETHYLESTERSCHEMBL839065Tryptophan, ethyl ester, DL-
Show more names
CHEMBL1229085DABYEOZXRSTEGL-UHFFFAOYSA-DABYEOZXRSTEGL-UHFFFAOYSA-NHMS1610K16CCG-16894AKOS001626740AKOS016316055ethyl 2-amino-3-indol-3-ylpropanoate
Database identifiers
- CAS
6519-66-0- PubChem CID
- 134520
- ChEMBL
CHEMBL1229085- UNII
- U4U6385NKL
- Nikkaji
- J2.449.373C
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 68.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 270
Related reactions
1 records
Compound notes
Loading…