ChemicalBook--->CAS DataBase List--->60948-91-6

60948-91-6

60948-91-6 Structure

60948-91-6 Structure
IdentificationBack Directory
[Name]

2-HEXYLOCTANOIC ACID
[CAS]

60948-91-6
[Synonyms]

Ai3-11063
Einecs 262-534-2
Hexyloctanoic acid
2-hexyl-octanoicaci
2-HEXYLOCTANOIC ACID
2-BUTYL DECANOIC ACID
Octanoic acid, 2-hexyl-
[EINECS(EC#)]

262-534-2
[Molecular Formula]

C14H28O2
[MDL Number]

MFCD02262178
[MOL File]

60948-91-6.mol
[Molecular Weight]

228.37
Chemical PropertiesBack Directory
[Boiling point ]

159-160 °C(Press: 4 Torr)
[density ]

0.8895 g/cm3
[refractive index ]

1.4421 (589.3 nm 20℃)
[storage temp. ]

Storage temp. 2-8°C
[pka]

4.90±0.40(Predicted)
[Appearance]

Colorless to light yellow Liquid
[InChI]

InChI=1S/C14H28O2/c1-3-5-7-9-11-13(14(15)16)12-10-8-6-4-2/h13H,3-12H2,1-2H3,(H,15,16)
[InChIKey]

SQPZLZZLAPHSPL-UHFFFAOYSA-N
[SMILES]

C(O)(=O)C(CCCCCC)CCCCCC
[LogP]

5.636 (est)
[EPA Substance Registry System]

2-Hexyloctanoic acid (60948-91-6)
Safety DataBack Directory
[TSCA ]

TSCA listed
Spectrum DetailBack Directory
[Spectrum Detail]

2-HEXYLOCTANOIC ACID(60948-91-6)1HNMR
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