| CAS Number | 1019521-50-6 |
| Catalog Number | AG019YL5(AGN-PC-0WOAH7) |
| Chemical Name | 3-(Cyclopropylmethoxy)propanoic acid |
| IUPAC Name | 3-(cyclopropylmethoxy)propanoic acid |
| InChI | InChI=1S/C7H12O3/c8-7(9)3-4-10-5-6-1-2-6/h6H,1-5H2,(H,8,9) |
| InChI Key | DBHJVWKLRYOYFI-UHFFFAOYSA-N |
| MDL Number | MFCD11136575 |
| Molecular Formula | C7H12O3 |
| Molecular Weight | 144.1684 |
| SMILES | OC(CCOCC1CC1)=O |
| Synonyms | 3-(cyclopropylmethoxy)propanoic acid,
1019521-50-6,
ZINC19870468,
AKOS000220984,
MCULE-4509324999,
NE39712,
3-Cyclopropylmethoxy-propionic acid,
|
| Complexity | 118 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 144.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 144.17g/mol |
| Monoisotopic Mass | 144.079g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 46.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number