CITRONELLYL ISOBUTYRATE

Details

Stereochemistry	RACEMIC
Molecular Formula	C14H26O2
Molecular Weight	226.355
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(CCOC(=O)C(C)C)CCC=C(C)C

InChI

InChIKey=ZGPPERKMXSGYRK-UHFFFAOYSA-N

InChI=1S/C14H26O2/c1-11(2)7-6-8-13(5)9-10-16-14(15)12(3)4/h7,12-13H,6,8-10H2,1-5H3

HIDE SMILES / InChI

Molecular Formula	C14H26O2
Molecular Weight	226.355
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 18:41:17 GMT 2025` Edited by `admin` on `Mon Mar 31 18:41:17 GMT 2025`
Record UNII	5RZR3JKW1P
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

CITRONELLYL ISOBUTYRATE

Systematic Name

English

FEMA NO. 2313

Preferred Name

English

PROPANOIC ACID, 2-METHYL-, 3,7-DIMETHYL-6-OCTENYL

Common Name

English

3,7-DIMETHYL-6-OCTEN-1-YL ISOBUTYRATE

Systematic Name

English

CITRONELLYL ISOBUTYRATE, (±)-

Systematic Name

English

NSC-46148

Code

English

ISOBUTYRIC ACID, 3,7-DIMETHYL-6-OCTENYL ESTER

Common Name

English

PROPANOIC ACID, 2-METHYL-, 3,7-DIMETHYL-6-OCTEN-1-YL ESTER

Common Name

English

PROPANOIC ACID, 2-METHYL-, 3,7-DIMETHYL-6-OCTENYL ESTER

Common Name

English

CITRONELLYL ISOBUTYRATE [FHFI]

Common Name

English

CITRONELLYL ISOBUTYRATE [FCC]

Common Name

English

CITRONELLYL ISOBUTYRATE, (RS)-

Systematic Name

English

3,7-DIMETHYLOCT-6-ENYL ISOBUTYRATE

Systematic Name

English

Classification Tree Code System Code

JECFA EVALUATION

CITRONELLYL ISOBUTYRATE