| CAS Number | 1016680-44-6 |
| Catalog Number | AG019Y0O(AGN-PC-0WO2Q7) |
| Chemical Name | 2-[(oxolan-2-yl)methoxy]propanoic acid |
| IUPAC Name | 2-(oxolan-2-ylmethoxy)propanoic acid |
| InChI | InChI=1S/C8H14O4/c1-6(8(9)10)12-5-7-3-2-4-11-7/h6-7H,2-5H2,1H3,(H,9,10) |
| InChI Key | BNCXIKWGIAISFC-UHFFFAOYSA-N |
| MDL Number | MFCD09930520 |
| Molecular Formula | C8H14O4 |
| Molecular Weight | 174.1944 |
| SMILES | CC(C(O)=O)OCC1OCCC1 |
| Synonyms | 2-(oxolan-2-ylmethoxy)propanoic acid,
1016680-44-6,
AC1Q2C3D,
CTK7I5156,
AKOS000171173,
AKOS016904051,
MCULE-1083050078,
NE18712,
EN300-56570,
|
| Complexity | 157 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 174.089g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 174.196g/mol |
| Monoisotopic Mass | 174.089g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 55.8A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number