CAS Registry Number®
27610-92-0
CAS Name
2-Butyloctanoic acid
Molecular Formula
C12H24O2
Molecular Mass
200.32
Compound Properties
-
Boiling Point (1)
114-116 °C @ Press: 2.5 Torr
-
Density (2)
0.8923 g/cm³ @ Temp: 20 °C
Source(s)
- (1) Pratt, Ernest F.; Journal of the American Chemical Society, (1954), 76, 52-6, CAplus
- (2) Hill, Carl M.; Journal of the American Chemical Society, (1953), 75, 4591, CAplus
Other Names and Identifiers
InChI
InChI=1S/C12H24O2/c1-3-5-7-8-10-11(12(13)14)9-6-4-2/h11H,3-10H2,1-2H3,(H,13,14)
InChIKey
InChIKey=OARDBPIZDHVTCK-UHFFFAOYSA-N
SMILES
C(CCCCCC)(CCCC)C(O)=O
Canonical SMILES
O=C(O)C(CCCC)CCCCCC
Other Names for this Substance
- Octanoic acid, 2-butyl-
- 2-Butyloctanoic acid
- α-Butylcaprylic acid
- Isocarb 12
- Jaric I 12
- 2-Butyl-caprylic acid
Deleted or Replaced CAS Registry Numbers
53687-45-9
