| CAS Number | 849402-65-9 |
| Catalog Number | AG003AMA(AGN-PC-0OJGUV) |
| Chemical Name | 4-Methoxy-2-methylbenzoxazole |
| IUPAC Name | 4-methoxy-2-methyl-1,3-benzoxazole |
| InChI | InChI=1S/C9H9NO2/c1-6-10-9-7(11-2)4-3-5-8(9)12-6/h3-5H,1-2H3 |
| InChI Key | NCSILNBMCGMRHU-UHFFFAOYSA-N |
| MDL Number | MFCD26517732 |
| Molecular Formula | C9H9NO2 |
| Molecular Weight | 163.1733 |
| SMILES | COC1=CC=CC2=C1N=C(O2)C |
| Synonyms | 4-methoxy-2-methylbenzo[d]oxazole,
849402-65-9,
4-Methoxy-2-methylbenzoxazole,
Benzoxazole, 4-methoxy-2-methyl-,
4-Methoxy-2-methyl-benzooxazole,
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| Complexity | 163 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 163.063g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 163.176g/mol |
| Monoisotopic Mass | 163.063g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 35.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number