3-Methylbutyl 1-hydroxycyclopentanecarboxylate
Basic information
- CAS
7144-66-3- Standard SMILES
CC(C)CCOC(=O)C1(O)CCCC1- InChIKey
QPCAMOSHLHFZLJ-UHFFFAOYSA-N- Molecular formula
- C11H20O3
- Average molar mass
- 200.27 g/mol
- Monoisotopic mass
- 200.1412445
Names & identifiers
- Preferred name
- 3-Methylbutyl 1-hydroxycyclopentanecarboxylate
- IUPAC
- 3-methylbutyl 1-hydroxycyclopentane-1-carboxylate
Names & synonyms
7144-66-33-methylbutyl 1-hydroxycyclopentanecarboxylate3-methylbutyl 1-hydroxycyclopentane-1-carboxylateNSC57416DTXSID30288738NSC-57416
Database identifiers
- CAS
7144-66-3- PubChem CID
- 245455
- DTXSID
DTXSID30288738
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 193
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…