Acetic acid, [[5-methyl-2-(1-methylethyl)cyclohexyl]oxy]-


Chemical Name: Acetic acid, [[5-methyl-2-(1-methylethyl)cyclohexyl]oxy]-
CAS Number: 71420-37-6
Product Number: AG00FUSF(AGN-PC-030UJZ)
Synonyms:
MDL No: MFCD00001483
Molecular Formula: C12H22O3
Molecular Weight: 214.3013

Identification/Properties


Computed Properties
Molecular Weight:
214.305g/mol
XLogP3:
3.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
214.157g/mol
Monoisotopic Mass:
214.157g/mol
Topological Polar Surface Area:
46.5A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
213
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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