| CAS Number | 1094307-11-5 |
| Catalog Number | AG019WY0(AGN-PC-0WO1V4) |
| Chemical Name | 3-ethyl-1-hydroxycyclopentane-1-carboxylic acid |
| IUPAC Name | 3-ethyl-1-hydroxycyclopentane-1-carboxylic acid |
| InChI | InChI=1S/C8H14O3/c1-2-6-3-4-8(11,5-6)7(9)10/h6,11H,2-5H2,1H3,(H,9,10) |
| InChI Key | NPUFEUGQBSXNBR-UHFFFAOYSA-N |
| MDL Number | MFCD11181324 |
| Molecular Formula | C8H14O3 |
| Molecular Weight | 158.1950 |
| SMILES | CCC1CC(C(O)=O)(O)CC1 |
| Synonyms | 3-ethyl-1-hydroxycyclopentane-1-carboxylic acid,
1094307-11-5,
AC1Q2UAW,
CTK6D1190,
AKOS009309809,
MCULE-3641341110,
NE59847,
EN300-53491,
AB01004614-01,
|
| Complexity | 167 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 158.094g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 158.197g/mol |
| Monoisotopic Mass | 158.094g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 57.5A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number