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Details

Stereochemistry ACHIRAL
Molecular Formula C9H16O2
Molecular Weight 156.2221
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 3-Heptenyl acetate, trans-

SMILES

CCC\C=C\CCOC(C)=O

InChI

InChIKey=AAYIYWGTGAUKQY-AATRIKPKSA-N
InChI=1S/C9H16O2/c1-3-4-5-6-7-8-11-9(2)10/h5-6H,3-4,7-8H2,1-2H3/b6-5+

HIDE SMILES / InChI

Molecular Formula C9H16O2
Molecular Weight 156.2221
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 19:01:48 GMT 2025
Edited
by admin
on Mon Mar 31 19:01:48 GMT 2025
Record UNII
R6VN5HBW4C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-Hepten-1-ol, acetate, (3E)-
Preferred Name English
3-Heptenyl acetate, trans-
Systematic Name English
trans-3-Heptenyl acetate [FHFI]
Common Name English
3-HEPTEN-1-OL, ACETATE, (E)-
Systematic Name English
3-Heptenyl acetate, (3E)-
Systematic Name English
(E)-HEPT-3-ENYL ACETATE
Systematic Name English
3-HEPTEN-1-YL ACETATE, (E)-
Systematic Name English
3-HEPTENYL ACETATE, (E)-
Systematic Name English
FEMA NO. 3493
Code English
Classification Tree Code System Code
JECFA EVALUATION TRANS-3-HEPTENYL ACETATE
Created by admin on Mon Mar 31 19:01:48 GMT 2025 , Edited by admin on Mon Mar 31 19:01:48 GMT 2025
Code System Code Type Description
ECHA (EC/EINECS)
216-411-5
Created by admin on Mon Mar 31 19:01:48 GMT 2025 , Edited by admin on Mon Mar 31 19:01:48 GMT 2025
PRIMARY
EPA CompTox
DTXSID301014580
Created by admin on Mon Mar 31 19:01:48 GMT 2025 , Edited by admin on Mon Mar 31 19:01:48 GMT 2025
PRIMARY
JECFA MONOGRAPH
243
Created by admin on Mon Mar 31 19:01:48 GMT 2025 , Edited by admin on Mon Mar 31 19:01:48 GMT 2025
PRIMARY
CAS
1576-77-8
Created by admin on Mon Mar 31 19:01:48 GMT 2025 , Edited by admin on Mon Mar 31 19:01:48 GMT 2025
PRIMARY
PUBCHEM
5363206
Created by admin on Mon Mar 31 19:01:48 GMT 2025 , Edited by admin on Mon Mar 31 19:01:48 GMT 2025
PRIMARY
FDA UNII
R6VN5HBW4C
Created by admin on Mon Mar 31 19:01:48 GMT 2025 , Edited by admin on Mon Mar 31 19:01:48 GMT 2025
PRIMARY