ChemicalBook--->CAS DataBase List--->26896-18-4

26896-18-4

26896-18-4 Structure

26896-18-4 Structure
IdentificationBack Directory
[Name]

Isononanoic acid
[CAS]

26896-18-4
[Synonyms]

Isononansaure
I-NONANOICACID
Isononanoicaci
ISONONANOIC ACID
Methyloctanoicacid
7-methylcaprylic acid
7-METHYL OCTANOIC ACID
[EINECS(EC#)]

248-092-3
[Molecular Formula]

C9H18O2
[MDL Number]

MFCD00055380
[MOL File]

26896-18-4.mol
[Molecular Weight]

158.24
Questions And AnswerBack Directory
[Preparation]

Isononanoic acid was prepared by oxidation under acidic conditions using isononol as raw material, hydrogen peroxide solution as oxidant, and a co-oxidant and phase transfer catalyst.
[Uses]

Isononanoic acid has a wide range of applications. It can be used as a pharmaceutical intermediate, a synthetic lubricant intermediate, a raw material for metalworking fluids, and can also be used for the modification of alkyd resins.
Chemical PropertiesBack Directory
[InChI]

InChI=1S/C9H18O2/c1-8(2)6-4-3-5-7-9(10)11/h8H,3-7H2,1-2H3,(H,10,11)
[InChIKey]

XZOYHFBNQHPJRQ-UHFFFAOYSA-N
[SMILES]

C(C)(C)CCCCCC(=O)O
[EPA Substance Registry System]

Isononanoic acid (26896-18-4)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)Corrosion (GHS05)
GHS07,GHS05
[Signal word ]

Danger
[Hazard statements ]

H318-H302-H315
[Precautionary statements ]

P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310-P264-P270-P301+P312-P330-P501
[TSCA ]

TSCA listed
[REACH Registrations]

Active
Hazard InformationBack Directory
[Definition]

ChEBI: 7-methyloctanoic acid is a branched-chain saturated fatty acid consisting of octanoic acid carrying a 7-methyl group. It is a branched-chain saturated fatty acid, a medium-chain fatty acid and a methyl-branched fatty acid.
[Synthesis Reference(s)]

Tetrahedron Letters, 17, p. 4697, 1976 DOI: 10.1016/S0040-4039(00)92999-X
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