5-Decyne-4,7-diol, 2,4,7,9-tetramethyl-


Chemical Name: 5-Decyne-4,7-diol, 2,4,7,9-tetramethyl-
CAS Number: 126-86-3
Product Number: AG000QOL(AGN-PC-0JKLVH)
Synonyms:
MDL No:
Molecular Formula: C14H26O2
Molecular Weight: 226.3550

Identification/Properties


Properties
MP:
42-44 °C
BP:
255°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Refractive Index:
1.4560 (estimate)
Computed Properties
Molecular Weight:
226.36g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
6
Exact Mass:
226.193g/mol
Monoisotopic Mass:
226.193g/mol
Topological Polar Surface Area:
40.5A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
256
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
2
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:
H319
Precautionary Statements:
P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



2,4,7,9-Tetramethyl-5-Decyne-4,7-Diol is a versatile compound widely used in chemical synthesis. It serves as a valuable building block in the creation of various organic molecules due to its unique structure and reactivity. In organic synthesis, this compound can participate in a range of reactions to introduce functional groups, modify existing structures, and facilitate the formation of complex compounds. Its alkyne functional group is particularly valuable in carbon-carbon bond formation reactions, providing a stable platform for further derivatization. Additionally, the symmetric nature of 2,4,7,9-Tetramethyl-5-Decyne-4,7-Diol lends itself well to stereocontrolled reactions, making it a valuable tool for the synthesis of stereochemically-defined molecules. Its utility in chemical synthesis extends to the preparation of advanced materials, pharmaceutical intermediates, and agrochemicals, showcasing its importance in the field of organic chemistry.