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Details

Stereochemistry ACHIRAL
Molecular Formula C12H12F2O4
Molecular Weight 258.2181
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(3-Buten-1-yloxy)-4-(difluoromethoxy)benzoic acid

SMILES

OC(=O)C1=CC(OCCC=C)=C(OC(F)F)C=C1

InChI

InChIKey=MEAFPACCBCNDQU-UHFFFAOYSA-N
InChI=1S/C12H12F2O4/c1-2-3-6-17-10-7-8(11(15)16)4-5-9(10)18-12(13)14/h2,4-5,7,12H,1,3,6H2,(H,15,16)

HIDE SMILES / InChI

Molecular Formula C12H12F2O4
Molecular Weight 258.2181
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 Wed Apr 02 19:49:51 GMT 2025
Edited
by admin
on Wed Apr 02 19:49:51 GMT 2025
Record UNII
RQ9CXB8HCB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(3-Buten-1-yloxy)-4-(difluoromethoxy)benzoic acid
Systematic Name English
4-Difluoromethoxy-3-(3-butenyloxy)benzoic acid
Preferred Name English
Benzoic acid, 3-(3-buten-1-yloxy)-4-(difluoromethoxy)-
Systematic Name English
Code System Code Type Description
FDA UNII
RQ9CXB8HCB
Created by admin on Wed Apr 02 19:49:51 GMT 2025 , Edited by admin on Wed Apr 02 19:49:51 GMT 2025
PRIMARY
CAS
1882067-44-8
Created by admin on Wed Apr 02 19:49:51 GMT 2025 , Edited by admin on Wed Apr 02 19:49:51 GMT 2025
PRIMARY