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Details

Stereochemistry ACHIRAL
Molecular Formula C12H8F17NO4S
Molecular Weight 585.234
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(N-ETHYLPERFLUOROOCTANESULFONAMIDO)ACETIC ACID

SMILES

CCN(CC(O)=O)S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

InChI

InChIKey=CKRXVVGETMYFIO-UHFFFAOYSA-N
InChI=1S/C12H8F17NO4S/c1-2-30(3-4(31)32)35(33,34)12(28,29)10(23,24)8(19,20)6(15,16)5(13,14)7(17,18)9(21,22)11(25,26)27/h2-3H2,1H3,(H,31,32)

HIDE SMILES / InChI

Molecular Formula C12H8F17NO4S
Molecular Weight 585.234
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 Tue Apr 01 19:20:57 GMT 2025
Edited
by admin
on Tue Apr 01 19:20:57 GMT 2025
Record UNII
IT4R503EPH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(N-ETHYLPERFLUOROOCTANESULFONAMIDO)ACETIC ACID
Systematic Name English
GLYCINE, N-ETHYL-N-((1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-HEPTADECAFLUOROOCTYL)SULFONYL)-
Preferred Name English
N-ETHYL-N-((1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-HEPTADECAFLUOROOCTYL)SULFONYL)GLYCINE
Systematic Name English
Code System Code Type Description
FDA UNII
IT4R503EPH
Created by admin on Tue Apr 01 19:20:57 GMT 2025 , Edited by admin on Tue Apr 01 19:20:57 GMT 2025
PRIMARY
CAS
2991-50-6
Created by admin on Tue Apr 01 19:20:57 GMT 2025 , Edited by admin on Tue Apr 01 19:20:57 GMT 2025
PRIMARY
ECHA (EC/EINECS)
221-061-1
Created by admin on Tue Apr 01 19:20:57 GMT 2025 , Edited by admin on Tue Apr 01 19:20:57 GMT 2025
PRIMARY
EPA CompTox
DTXSID5062760
Created by admin on Tue Apr 01 19:20:57 GMT 2025 , Edited by admin on Tue Apr 01 19:20:57 GMT 2025
PRIMARY
PUBCHEM
18134
Created by admin on Tue Apr 01 19:20:57 GMT 2025 , Edited by admin on Tue Apr 01 19:20:57 GMT 2025
PRIMARY