(I S)-I-Amino-4,5-dimethyl-2-furanpentanoic acid
Basic information
- CAS
1213953-16-2- Standard SMILES
Cc1cc([C@@H](N)CCCC(=O)O)oc1C- InChIKey
VPLBGZVNTDUFLB-VIFPVBQESA-N- Molecular formula
- C11H17NO3
- Average molar mass
- 211.26 g/mol
- Monoisotopic mass
- 211.1208434
Names & identifiers
- Preferred name
- (I S)-I-Amino-4,5-dimethyl-2-furanpentanoic acid
- IUPAC
- (5S)-5-amino-5-(4,5-dimethylfuran-2-yl)pentanoic acid
Names & synonyms
DTXSID201245267(I S)-I -Amino-4,5-dimethyl-2-furanpentanoic acid(5S)-5-Amino-5-(4,5-dimethylfuran-2-yl)pentanoic acid1213953-16-2
Database identifiers
- CAS
1213953-16-2- PubChem CID
- 165348751
- DTXSID
DTXSID201245267
Properties
Computed structural properties
- XLogP
- -1.4
- Topological polar surface area
- 76.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 220
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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