| CAS Number | 1422273-86-6 |
| Catalog Number | AG01C33Y |
| Chemical Name | rac-[(1R,2S)-2-ethynylcyclopropyl]methanol, cis |
| IUPAC Name | (2-ethynylcyclopropyl)methanol |
| InChI | InChI=1S/C6H8O/c1-2-5-3-6(5)4-7/h1,5-7H,3-4H2 |
| InChI Key | LKUCMEHIFVXSGA-UHFFFAOYSA-N |
| MDL Number | MFCD30012455 |
| Molecular Formula | C6H8O |
| Molecular Weight | 96.1271 |
| SMILES | OC[C@@H]1[C@H](C#C)C1 |
| Synonyms | (2-ethynylcyclopropyl)methanol,
144478-66-0,
[Cis-2-ethynylcyclopropyl]methanol,
1422273-86-6,
[Trans-2-ethynylcyclopropyl]methanol,
DA-44618,
CS-0067820,
FT-0768967,
1410809-74-3,
|
| Complexity | 109 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 96.058g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 96.129g/mol |
| Monoisotopic Mass | 96.058g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
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Certificate of Analysis
Lot Number