| CAS Number | 833460-92-7 |
| Catalog Number | AG004W8I(AGN-PC-01XQK9) |
| Chemical Name | 1,2-Dimethyl-3-propoxybenzene |
| IUPAC Name | 1,2-dimethyl-3-propoxybenzene |
| InChI | InChI=1S/C11H16O/c1-4-8-12-11-7-5-6-9(2)10(11)3/h5-7H,4,8H2,1-3H3 |
| InChI Key | OXVZEOYNXOZOFP-UHFFFAOYSA-N |
| MDL Number | MFCD26386335 |
| Molecular Formula | C11H16O |
| Molecular Weight | 164.2441 |
| SMILES | CCCOc1cccc(c1C)C |
| Synonyms | 1,2-Dimethyl-3-propoxybenzene,
833460-92-7,
Benzene, 1,2-dimethyl-3-propoxy-,
SCHEMBL7216294,
CTK3D2763,
DTXSID50594984,
OXVZEOYNXOZOFP-UHFFFAOYSA-N,
2,3-Dimethylphenol, n-propyl ether,
ZINC90449106,
AKOS026673826,
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| Complexity | 122 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 164.12g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 164.248g/mol |
| Monoisotopic Mass | 164.12g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number