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Details

Stereochemistry ACHIRAL
Molecular Formula C13H16O4
Molecular Weight 236.2637
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,3-BENZODIOXOL-5-YLMETHYL PIVALATE

SMILES

CC(C)(C)C(=O)OCC1=CC2=C(OCO2)C=C1

InChI

InChIKey=QIKMSBWNVVQENG-UHFFFAOYSA-N
InChI=1S/C13H16O4/c1-13(2,3)12(14)15-7-9-4-5-10-11(6-9)17-8-16-10/h4-6H,7-8H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C13H16O4
Molecular Weight 236.2637
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:31:59 GMT 2023
Edited
by admin
on Sat Dec 16 12:31:59 GMT 2023
Record UNII
GT5MBA66VS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,3-BENZODIOXOL-5-YLMETHYL PIVALATE
Systematic Name English
Propanoic acid, 2,2-dimethyl-, 1,3-benzodioxol-5-ylmethyl ester
Common Name English
1,3-benzodioxol-5-ylmethyl2,2-dimethylpropanoate
Systematic Name English
Piperonyl alcohol, pivalate
Common Name English
NSC-405134
Code English
Code System Code Type Description
CAS
6471-96-1
Created by admin on Sat Dec 16 12:31:59 GMT 2023 , Edited by admin on Sat Dec 16 12:31:59 GMT 2023
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EPA CompTox
DTXSID80215059
Created by admin on Sat Dec 16 12:31:59 GMT 2023 , Edited by admin on Sat Dec 16 12:31:59 GMT 2023
PRIMARY
FDA UNII
GT5MBA66VS
Created by admin on Sat Dec 16 12:31:59 GMT 2023 , Edited by admin on Sat Dec 16 12:31:59 GMT 2023
PRIMARY
NSC
405134
Created by admin on Sat Dec 16 12:31:59 GMT 2023 , Edited by admin on Sat Dec 16 12:31:59 GMT 2023
PRIMARY
PUBCHEM
80962
Created by admin on Sat Dec 16 12:31:59 GMT 2023 , Edited by admin on Sat Dec 16 12:31:59 GMT 2023
PRIMARY
ECHA (EC/EINECS)
229-320-0
Created by admin on Sat Dec 16 12:31:59 GMT 2023 , Edited by admin on Sat Dec 16 12:31:59 GMT 2023
PRIMARY