1-Octyn-4-ol, 4-methyl-


Chemical Name: 1-Octyn-4-ol, 4-methyl-
CAS Number: 22128-43-4
Product Number: AG00BJNH(AGN-PC-00JXIL)
Synonyms:
MDL No:
Molecular Formula: C9H16O
Molecular Weight: 140.2227

Identification/Properties


Properties
MP:
-16°C (estimate)
BP:
226.76°C (rough estimate)
Storage:
2-8℃;Keep in dry area;
Form:
Liquid
Refractive Index:
1.4395 (estimate)
Computed Properties
Molecular Weight:
140.226g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
4
Exact Mass:
140.12g/mol
Monoisotopic Mass:
140.12g/mol
Topological Polar Surface Area:
20.2A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
131
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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