Bicyclo[6.1.0]non-4-yne-9-methanol, (1α,8α,9α)- - CAS 1263291-41-3
Catalog: |
BB054512 |
Product Name: |
Bicyclo[6.1.0]non-4-yne-9-methanol, (1α,8α,9α)- |
CAS: |
1263291-41-3 |
Synonyms: |
(1α,8α,9α)-Bicyclo[6.1.0]non-4-yne-9-methanol; exo-Bicyclo[6.1.0]non-4-yn-9-ylmethanol |
IUPAC Name: | [(1S,8R)-9-bicyclo[6.1.0]non-4-ynyl]methanol |
Molecular Weight: | 150.22 |
Molecular Formula: | C10H14O |
Canonical SMILES: | OCC1C2CCC#CCCC12 |
InChI: | InChI=1/C10H14O/c11-7-10-8-5-3-1-2-4-6-9(8)10/h8-11H,3-7H2/t8-,9+,10+ |
InChI Key: | NSVXZMGWYBICRW-MYJAWHEDNA-N |
Boiling Point: | 256.5±9.0 °C at 760 mmHg |
Density: | 1.08±0.1 g/cm3 |
Complexity: | 189 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 150.104465066 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 150.104465066 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 20.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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