5-(2,2-Dimethyl-2,5-dihydro-1,3-thiazol-5-yl)pentanoic acid
Basic information
- CAS
89149-11-1- Standard SMILES
CC1(C)N=CC(CCCCC(=O)O)S1- InChIKey
VDNSCJGWGXCBRJ-UHFFFAOYSA-N- Molecular formula
- C10H17NO2S
- Average molar mass
- 215.31 g/mol
- Monoisotopic mass
- 215.09799996
Names & identifiers
- Preferred name
- 5-(2,2-Dimethyl-2,5-dihydro-1,3-thiazol-5-yl)pentanoic acid
- IUPAC
- 5-(2,2-dimethyl-5H-1,3-thiazol-5-yl)pentanoic acid
Names & synonyms
89149-11-1SCHEMBL10669842DTXSID006120665-(2,2-Dimethyl-2,5-dihydro-1,3-thiazol-5-yl)pentanoic acid
Database identifiers
- CAS
89149-11-1- PubChem CID
- 21292268
- DTXSID
DTXSID00612066
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 75 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 238
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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