| CAS Number | 1226506-90-6 |
| Catalog Number | AG01A5HL(AGN-PC-0WO73I) |
| Chemical Name | (4-Ethyloxan-4-yl)methanol |
| IUPAC Name | (4-ethyloxan-4-yl)methanol |
| InChI | InChI=1S/C8H16O2/c1-2-8(7-9)3-5-10-6-4-8/h9H,2-7H2,1H3 |
| InChI Key | RIAJNPRZPWPQCV-UHFFFAOYSA-N |
| MDL Number | MFCD21670770 |
| Molecular Formula | C8H16O2 |
| Molecular Weight | 144.2114 |
| SMILES | CCC1(CCOCC1)CO |
| Synonyms | (4-ethyloxan-4-yl)methanol,
1226506-90-6,
(4-Ethyltetrahydro-2H-pyran-4-yl)methanol,
SCHEMBL2427203,
MFCD21670770,
ZINC85036607,
AKOS015366432,
MCULE-6335178539,
NE29077,
Z1626920970,
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| Complexity | 95.4 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 144.115g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 144.214g/mol |
| Monoisotopic Mass | 144.115g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
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Certificate of Analysis
Lot Number