| CAS Number | 1379662-52-8 |
| Catalog Number | AG01BDQF |
| Chemical Name | Bicyclo[6.1.0]non-4-yn-9-ylmethanol |
| IUPAC Name | 9-bicyclo[6.1.0]non-4-ynylmethanol |
| InChI | InChI=1S/C10H14O/c11-7-10-8-5-3-1-2-4-6-9(8)10/h8-11H,3-7H2 |
| InChI Key | NSVXZMGWYBICRW-UHFFFAOYSA-N |
| MDL Number | MFCD22549359 |
| Molecular Formula | C10H14O |
| Molecular Weight | 150.2176 |
| SMILES | OCC1C2CCC#CCCC21 |
| Synonyms | bicyclo[6.1.0]non-4-yn-9-ylmethanol,
1379662-52-8,
SCHEMBL2590528,
SCHEMBL18465645,
NSVXZMGWYBICRW-UHFFFAOYSA-N,
Bicyclo[6.1.0]nona-4-yne-9-methanol,
(1R,8S,9s)-Bicyclo[6.1.0]non-4-yn-9-ylmethanol,
|
| Complexity | 189 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 150.104g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 150.221g/mol |
| Monoisotopic Mass | 150.104g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number