| CAS Number | 173831-51-1 |
| Catalog Number | AG01B534 |
| Chemical Name | rac-[(1R,2R)-2-(4-methoxyphenyl)cyclopropyl]methanol, trans |
| IUPAC Name | [2-(4-methoxyphenyl)cyclopropyl]methanol |
| InChI | InChI=1S/C11H14O2/c1-13-10-4-2-8(3-5-10)11-6-9(11)7-12/h2-5,9,11-12H,6-7H2,1H3 |
| InChI Key | ZKFNRNDXRRPTBZ-UHFFFAOYSA-N |
| MDL Number | MFCD30012454 |
| Molecular Formula | C11H14O2 |
| Molecular Weight | 178.2277 |
| SMILES | COC1=CC=C([C@H]2[C@H](CO)C2)C=C1 |
| Synonyms | [2-(4-methoxyphenyl)cyclopropyl]methanol,
1352898-22-6,
SCHEMBL16585494,
173831-51-1,
AKOS019931171,
2-(4-Methoxyphenyl)cyclopropanemethanol,
[2-(4-methoxyphenyl)-cyclopropyl]-methanol,
Rac-[(1R,2R)-2-(4-methoxyphenyl)cyclopropyl]methanol,
|
| Complexity | 162 |
| 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 | 3 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
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Certificate of Analysis
Lot Number