| CAS Number | 1202643-83-1 |
| Catalog Number | AG01B6CY |
| Chemical Name | 1-(3-methoxyphenyl)cyclobutanol |
| IUPAC Name | 1-(3-methoxyphenyl)cyclobutan-1-ol |
| InChI | InChI=1S/C11H14O2/c1-13-10-5-2-4-9(8-10)11(12)6-3-7-11/h2,4-5,8,12H,3,6-7H2,1H3 |
| InChI Key | XKDFTUDIUBPWGJ-UHFFFAOYSA-N |
| MDL Number | MFCD21788758 |
| Molecular Formula | C11H14O2 |
| Molecular Weight | 178.2277 |
| SMILES | OC1(c2cc(OC)ccc2)CCC1 |
| Synonyms | 1-(3-methoxyphenyl)cyclobutan-1-ol,
1202643-83-1,
1-(3-methoxy-phenyl)-cyclobutanol,
SCHEMBL1660644,
1-(3-Methoxyphenyl)cyclobutanol,
XKDFTUDIUBPWGJ-UHFFFAOYSA-N,
ZINC84333998,
AKOS017631513,
Z2574909837,
|
| Complexity | 175 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 178.099g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 178.231g/mol |
| Monoisotopic Mass | 178.099g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number