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Details

Stereochemistry RACEMIC
Molecular Formula C9H18O2
Molecular Weight 158.238
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-HEPTANYL ACETATE

SMILES

CCCCC(CC)OC(C)=O

InChI

InChIKey=QICIMADZMWGDTQ-UHFFFAOYSA-N
InChI=1S/C9H18O2/c1-4-6-7-9(5-2)11-8(3)10/h9H,4-7H2,1-3H3

HIDE SMILES / InChI

Approval Year

Name Type Language
3-HEPTANYL ACETATE
Systematic Name English
HEPT-3-YL ETHANOATE
Systematic Name English
3-HEPTANOL, 3-ACETATE
Common Name English
1-ETHYLPENTYL ACETATE
Systematic Name English
FEMA NO. 3980
Code English
3-HEPTYL ACETATE
Systematic Name English
HEPTAN-3-YL ACETATE, (±)-
Systematic Name English
(±)-HEPTAN-3-YL ACETATE
Systematic Name English
3-HEPTANOL, ACETATE
Systematic Name English
Classification Tree Code System Code
JECFA EVALUATION (+/-)HEPTAN-3-YL ACETATE
Created by admin on Fri Dec 15 20:24:42 GMT 2023 , Edited by admin on Fri Dec 15 20:24:42 GMT 2023
Code System Code Type Description
EPA CompTox
DTXSID60904737
Created by admin on Fri Dec 15 20:24:42 GMT 2023 , Edited by admin on Fri Dec 15 20:24:42 GMT 2023
PRIMARY
CAS
5921-83-5
Created by admin on Fri Dec 15 20:24:42 GMT 2023 , Edited by admin on Fri Dec 15 20:24:42 GMT 2023
PRIMARY
JECFA MONOGRAPH
1075
Created by admin on Fri Dec 15 20:24:42 GMT 2023 , Edited by admin on Fri Dec 15 20:24:42 GMT 2023
PRIMARY
FDA UNII
79AS95G5J0
Created by admin on Fri Dec 15 20:24:42 GMT 2023 , Edited by admin on Fri Dec 15 20:24:42 GMT 2023
PRIMARY
PUBCHEM
537615
Created by admin on Fri Dec 15 20:24:42 GMT 2023 , Edited by admin on Fri Dec 15 20:24:42 GMT 2023
PRIMARY