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Details

Stereochemistry RACEMIC
Molecular Formula C14H24O2
Molecular Weight 224.3392
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LINALYL BUTYRATE

SMILES

CCCC(=O)OC(C)(CCC=C(C)C)C=C

InChI

InChIKey=FHLGUOHLUFIAAA-UHFFFAOYSA-N
InChI=1S/C14H24O2/c1-6-9-13(15)16-14(5,7-2)11-8-10-12(3)4/h7,10H,2,6,8-9,11H2,1,3-5H3

HIDE SMILES / InChI

Molecular Formula C14H24O2
Molecular Weight 224.3392
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

PubMed

PubMed

TitleDatePubMed
Fragrance material review on linalyl butyrate.
2003 Jul
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 18:00:20 GMT 2023
Edited
by admin
on Fri Dec 15 18:00:20 GMT 2023
Record UNII
7K9F6ZOH3S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LINALYL BUTYRATE
FHFI  
Systematic Name English
BUTANOIC ACID, 1-ETHENYL-1,5-DIMETHYL-4-HEXENYL ESTER
Common Name English
BUTYRIC ACID, 1,5-DIMETHYL-1-VINYL-4-HEXENYL ESTER
Common Name English
BUTANOIC ACID, 1-ETHENYL-1,5-DIMETHYL-4-HEXEN-1-YL ESTER
Common Name English
LINALYL BUTYRATE [FHFI]
Common Name English
3,7-DIMETHYL-1,6-OCTADIEN-3-YL BUTYRATE
Systematic Name English
1,6-OCTADIEN-3-OL, 3,7-DIMETHYL-, BUTYRATE
Systematic Name English
FEMA NO. 2639
Code English
NSC-46144
Code English
LINALYL BUTANOATE
Systematic Name English
3,7-DIMETHYL-1,6-OCTADIEN-3-OL BUTYRATE
Systematic Name English
LINALOOL BUTYRATE
Systematic Name English
BUTYRIC ACID LINALYL ESTER
Systematic Name English
Classification Tree Code System Code
CFR 21 CFR 172.515
Created by admin on Fri Dec 15 18:00:20 GMT 2023 , Edited by admin on Fri Dec 15 18:00:20 GMT 2023
JECFA EVALUATION LINALYL BUTYRATE
Created by admin on Fri Dec 15 18:00:20 GMT 2023 , Edited by admin on Fri Dec 15 18:00:20 GMT 2023
Code System Code Type Description
CAS
78-36-4
Created by admin on Fri Dec 15 18:00:20 GMT 2023 , Edited by admin on Fri Dec 15 18:00:20 GMT 2023
PRIMARY
EPA CompTox
DTXSID20861635
Created by admin on Fri Dec 15 18:00:20 GMT 2023 , Edited by admin on Fri Dec 15 18:00:20 GMT 2023
PRIMARY
ECHA (EC/EINECS)
201-109-8
Created by admin on Fri Dec 15 18:00:20 GMT 2023 , Edited by admin on Fri Dec 15 18:00:20 GMT 2023
PRIMARY
NSC
46144
Created by admin on Fri Dec 15 18:00:20 GMT 2023 , Edited by admin on Fri Dec 15 18:00:20 GMT 2023
PRIMARY
FDA UNII
7K9F6ZOH3S
Created by admin on Fri Dec 15 18:00:20 GMT 2023 , Edited by admin on Fri Dec 15 18:00:20 GMT 2023
PRIMARY
JECFA MONOGRAPH
362
Created by admin on Fri Dec 15 18:00:20 GMT 2023 , Edited by admin on Fri Dec 15 18:00:20 GMT 2023
PRIMARY
MESH
C475595
Created by admin on Fri Dec 15 18:00:20 GMT 2023 , Edited by admin on Fri Dec 15 18:00:20 GMT 2023
PRIMARY
PUBCHEM
62321
Created by admin on Fri Dec 15 18:00:20 GMT 2023 , Edited by admin on Fri Dec 15 18:00:20 GMT 2023
PRIMARY