| CAS Number | 569679-43-2 |
| Catalog Number | AG01BUUD(AGN-PC-0CN6Z4) |
| Chemical Name | 1-(Prop-2-en-1-yl)cyclobutan-1-ol |
| IUPAC Name | 1-prop-2-enylcyclobutan-1-ol |
| InChI | InChI=1S/C7H12O/c1-2-4-7(8)5-3-6-7/h2,8H,1,3-6H2 |
| InChI Key | GSYZJHHTZVBSQU-UHFFFAOYSA-N |
| MDL Number | MFCD23755500 |
| Molecular Formula | C7H12O |
| Molecular Weight | 112.1696 |
| SMILES | OC1(CCC1)CC=C |
| Synonyms | 1-(prop-2-en-1-yl)cyclobutan-1-ol,
569679-43-2,
1-Allylcyclobutanol,
SCHEMBL252753,
ZINC86716172,
AKOS018293101,
|
| Complexity | 92.6 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 112.089g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 112.172g/mol |
| Monoisotopic Mass | 112.089g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number