Alanine, N-(2-amino-3,4-cresotoyl)-, DL-
Basic information
- CAS
18877-35-5- Standard SMILES
Cc1ccc(C(=O)NC(C)C(=O)O)c(N)c1O- InChIKey
NRABWKFPYIDLJZ-UHFFFAOYSA-N- Molecular formula
- C11H14N2O4
- Average molar mass
- 238.24 g/mol
- Monoisotopic mass
- 238.09535693
Names & identifiers
- Preferred name
- Alanine, N-(2-amino-3,4-cresotoyl)-, DL-
- IUPAC
- 2-[(2-amino-3-hydroxy-4-methylbenzoyl)amino]propanoic acid
Names & synonyms
Alanine, N-(2-amino-3,4-cresotoyl)-, dl-18877-35-5RefChem:317995NRABWKFPYIDLJZ-UHFFFAOYSA-NDTXSID101277025N-(2-Amino-3-hydroxy-4-methylbenzoyl)alanineN-(2-Amino-3-hydroxy-4-methylbenzoyl)alanine #
Database identifiers
- CAS
18877-35-5- PubChem CID
- 613146
- DTXSID
DTXSID101277025
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 308
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…