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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H15F2IO3
Molecular Weight 396.1684
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of [(3S,5R)-5-(2,4-difluorophenyl)-5-(iodomethyl)tetrahydrofuran-3-yl]methyl acetate

SMILES

CC(=O)OC[C@@H]1CO[C@](CI)(C1)C2=CC=C(F)C=C2F

InChI

InChIKey=PJTYXCMPVMUITM-YGRLFVJLSA-N
InChI=1S/C14H15F2IO3/c1-9(18)19-6-10-5-14(8-17,20-7-10)12-3-2-11(15)4-13(12)16/h2-4,10H,5-8H2,1H3/t10-,14+/m1/s1

HIDE SMILES / InChI

Molecular Formula C14H15F2IO3
Molecular Weight 396.1684
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 17:09:04 GMT 2025
Edited
by admin
on Wed Apr 02 17:09:04 GMT 2025
Record UNII
8TG7LXL8FE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-Furanmethanol, 5-(2,4-difluorophenyl)tetrahydro-5-(iodomethyl)-, acetate, cis-
Preferred Name English
[(3S,5R)-5-(2,4-difluorophenyl)-5-(iodomethyl)tetrahydrofuran-3-yl]methyl acetate
Systematic Name English
Code System Code Type Description
FDA UNII
8TG7LXL8FE
Created by admin on Wed Apr 02 17:09:04 GMT 2025 , Edited by admin on Wed Apr 02 17:09:04 GMT 2025
PRIMARY
PUBCHEM
11036696
Created by admin on Wed Apr 02 17:09:04 GMT 2025 , Edited by admin on Wed Apr 02 17:09:04 GMT 2025
PRIMARY
CAS
169436-60-6
Created by admin on Wed Apr 02 17:09:04 GMT 2025 , Edited by admin on Wed Apr 02 17:09:04 GMT 2025
PRIMARY