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Details

Stereochemistry ACHIRAL
Molecular Formula C8H14F2O2
Molecular Weight 180.1924
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,2-Difluorohexanoic acid ethyl ester

SMILES

CCCCC(F)(F)C(=O)OCC

InChI

InChIKey=XTUTXYBGTIFZFQ-UHFFFAOYSA-N
InChI=1S/C8H14F2O2/c1-3-5-6-8(9,10)7(11)12-4-2/h3-6H2,1-2H3

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
2,2-Difluorohexanoic acid ethyl ester
Systematic Name English
Hexanoic acid, 2,2-difluoro-, ethyl ester
Systematic Name English
Ethyl 2,2-difluorohexanoate
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID60440302
Created by admin on Sat Dec 16 19:15:54 GMT 2023 , Edited by admin on Sat Dec 16 19:15:54 GMT 2023
PRIMARY
PUBCHEM
10464909
Created by admin on Sat Dec 16 19:15:54 GMT 2023 , Edited by admin on Sat Dec 16 19:15:54 GMT 2023
PRIMARY
CAS
74106-81-3
Created by admin on Sat Dec 16 19:15:54 GMT 2023 , Edited by admin on Sat Dec 16 19:15:54 GMT 2023
PRIMARY
FDA UNII
H5TS88M7Q6
Created by admin on Sat Dec 16 19:15:54 GMT 2023 , Edited by admin on Sat Dec 16 19:15:54 GMT 2023
PRIMARY
NIH
NCATS
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