| CAS Number | 3859-35-6 |
| Catalog Number | AG01BRHT(AGN-PC-0JOWL8) |
| Chemical Name | 1-ethenylcyclopentan-1-ol |
| IUPAC Name | 1-ethenylcyclopentan-1-ol |
| InChI | InChI=1S/C7H12O/c1-2-7(8)5-3-4-6-7/h2,8H,1,3-6H2 |
| InChI Key | JSQRFMSSEXQLTC-UHFFFAOYSA-N |
| MDL Number | MFCD21232005 |
| Molecular Formula | C7H12O |
| Molecular Weight | 112.1696 |
| NSC Number | 246158 |
| SMILES | OC1(C=C)CCCC1 |
| Synonyms | 1-ethenylcyclopentan-1-ol,
1-vinylcyclopentanol,
3859-35-6,
vinylcyclopentanol,
NSC246158,
1-ethenylcyclopentanol,
1-ethenyl-cyclopentanol,
AC1L7V5E,
SCHEMBL130275,
DTXSID70311877,
JSQRFMSSEXQLTC-UHFFFAOYSA-N,
ZINC1766474,
AKOS014753534,
NSC-246158,
CID317028,
|
| Complexity | 90.6 |
| 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 | 1 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number