3,7-Dimethyloctanoic acid
CAS Registry Number®
5698-27-1
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CAS Name
3,7-Dimethyloctanoic acidMolecular Formula
C10H20O2Molecular Mass
172.26Cite this Page
3,7-Dimethyloctanoic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=5698-27-1 (retrieved ) (CAS RN: 5698-27-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
195 °CDensity (2)
0.880 g/cm³ @ Temp: 17 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C10H20O2/c1-8(2)5-4-6-9(3)7-10(11)12/h8-9H,4-7H2,1-3H3,(H,11,12)
InChIKey
InChIKey=DGGBNSXAFVNQJU-UHFFFAOYSA-N
SMILES
C(CCCC(C)C)(CC(O)=O)C
Canonical SMILES
O=C(O)CC(C)CCCC(C)C
Other Names for this Substance
- Octanoic acid, 3,7-dimethyl-
- Caprylic acid, β,ζ-dimethyl-
- 3,7-Dimethyloctanoic acid
- Citronellic acid, dihydro-
- Geranic acid, tetrahydro-
Deleted or Replaced CAS Registry Numbers
57030-79-2
