Bicyclo[3.1.1]hept-2-ene-2-ethanol, 6,6-dimethyl-, (1R,5S)-


Chemical Name: Bicyclo[3.1.1]hept-2-ene-2-ethanol, 6,6-dimethyl-, (1R,5S)-
CAS Number: 35836-73-8
Product Number: AG003N0O(AGN-PC-0O9A8O)
Synonyms:
MDL No:
Molecular Formula: C11H18O
Molecular Weight: 166.2600

Identification/Properties


Properties
BP:
235°C at 760 mmHg
Storage:
Room Temperature;Keep in dry area;
Form:
Liquid
Refractive Index:
n20/D 1.493
Computed Properties
Molecular Weight:
166.264g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
2
Exact Mass:
166.136g/mol
Monoisotopic Mass:
166.136g/mol
Topological Polar Surface Area:
20.2A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
215
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



The compound (1R,5S)-6,6-Dimethylbicyclo[3.1.1]hept-2-ene-2-ethanol, commonly known as $name$, plays a significant role in chemical synthesis as a versatile building block. Due to its unique structure and functional groups, $name$ is utilized in the synthesis of various organic compounds and pharmaceutical intermediates. Its bicyclic framework provides rigidity and stereochemical control, making it a valuable chiral building block in asymmetric synthesis. Additionally, the presence of the hydroxyl group allows for further derivatization to introduce additional functionalities or to facilitate specific reactions. The use of $name$ in chemical synthesis enables chemists to access structurally complex molecules efficiently and in a controlled manner, highlighting its importance in modern organic chemistry research and drug development.