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Details

Stereochemistry ACHIRAL
Molecular Formula C6H8O2
Molecular Weight 112.1265
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 1,3-BUTADIENYL ACETATE, (1Z)-

SMILES

CC(=O)O\C=C/C=C

InChI

InChIKey=NMQQBXHZBNUXGJ-PLNGDYQASA-N
InChI=1S/C6H8O2/c1-3-4-5-8-6(2)7/h3-5H,1H2,2H3/b5-4-

HIDE SMILES / InChI

Molecular Formula C6H8O2
Molecular Weight 112.1265
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 Fri Dec 15 20:32:57 GMT 2023
Edited
by admin
on Fri Dec 15 20:32:57 GMT 2023
Record UNII
45XHF1QZE6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,3-BUTADIENYL ACETATE, (1Z)-
Systematic Name English
1,3-BUTADIEN-1-OL, ACETATE, (Z)-
Systematic Name English
1,3-BUTADIEN-1-OL, ACETATE, (1Z)-
Systematic Name English
CIS-1-ACETOXY-1,3-BUTADIENE
Systematic Name English
(Z)-1-ACETOXY-1,3-BUTADIENE
Systematic Name English
1,3-BUTADIEN-1-OL, 1-ACETATE, (1Z)-
Common Name English
Code System Code Type Description
CAS
35694-19-0
Created by admin on Fri Dec 15 20:32:57 GMT 2023 , Edited by admin on Fri Dec 15 20:32:57 GMT 2023
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FDA UNII
45XHF1QZE6
Created by admin on Fri Dec 15 20:32:57 GMT 2023 , Edited by admin on Fri Dec 15 20:32:57 GMT 2023
PRIMARY
PUBCHEM
11286451
Created by admin on Fri Dec 15 20:32:57 GMT 2023 , Edited by admin on Fri Dec 15 20:32:57 GMT 2023
PRIMARY