| CAS Number | 1083424-35-4 |
| Catalog Number | AG018RTG(AGN-PC-0WBPRN) |
| Chemical Name | 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetic acid |
| IUPAC Name | 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetic acid |
| InChI | InChI=1S/C6H8N2O4/c1-4-7-5(12-8-4)2-11-3-6(9)10/h2-3H2,1H3,(H,9,10) |
| InChI Key | HCLXDMHMZNTZMP-UHFFFAOYSA-N |
| MDL Number | MFCD14620962 |
| Molecular Formula | C6H8N2O4 |
| Molecular Weight | 172.1387 |
| SMILES | CC1N=C(COCC(O)=O)ON=1 |
| Synonyms | 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetic acid,
1083424-35-4,
ZINC20441092,
AKOS008146402,
MCULE-3734792385,
NE36403,
EN300-77006,
F8880-4076,
Z1259339923,
2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetic acid, AldrichCPR,
|
| Complexity | 164 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 172.048g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 172.14g/mol |
| Monoisotopic Mass | 172.048g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 85.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number