Octanoic acid, 3-hydroxy-6-methyl-


Chemical Name: Octanoic acid, 3-hydroxy-6-methyl-
CAS Number: 59896-39-8
Product Number: AG003TGS(AGN-PC-0BI384)
Synonyms:
MDL No:
Molecular Formula: C9H18O3
Molecular Weight: 174.2374

Identification/Properties


Properties
Storage:
Room Temperature;
Form:
Liquid
Computed Properties
Molecular Weight:
174.24g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
6
Exact Mass:
174.126g/mol
Monoisotopic Mass:
174.126g/mol
Topological Polar Surface Area:
57.5A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
134
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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