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Details

Stereochemistry ACHIRAL
Molecular Formula C15H34N.C3HF4O2
Molecular Weight 373.4696
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (DODECYL)TRIMETHYLAMMONIUM 2,2,3,3-TETRAFLUOROPROPIONATE

SMILES

[O-]C(=O)C(F)(F)C(F)F.CCCCCCCCCCCC[N+](C)(C)C

InChI

InChIKey=ORNIFVVKJYQEGF-UHFFFAOYSA-M
InChI=1S/C15H34N.C3H2F4O2/c1-5-6-7-8-9-10-11-12-13-14-15-16(2,3)4;4-1(5)3(6,7)2(8)9/h5-15H2,1-4H3;1H,(H,8,9)/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula C15H34N
Molecular Weight 228.4372
Charge 1
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C3HF4O2
Molecular Weight 145.0325
Charge -1
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 11:58:26 GMT 2023
Edited
by admin
on Sat Dec 16 11:58:26 GMT 2023
Record UNII
VSP82YH5EK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(DODECYL)TRIMETHYLAMMONIUM 2,2,3,3-TETRAFLUOROPROPIONATE
Systematic Name English
1-DODECANAMINIUM, N,N,N-TRIMETHYL-, 2,2,3,3-TETRAFLUOROPROPANOATE (1:1)
Systematic Name English
PROPANOIC ACID, 2,2,3,3-TETRAFLUORO-, ION(1-), N,N,N-TRIMETHYL-1-DODECANAMINIUM
Systematic Name English
Code System Code Type Description
PUBCHEM
25076598
Created by admin on Sat Dec 16 11:58:26 GMT 2023 , Edited by admin on Sat Dec 16 11:58:26 GMT 2023
PRIMARY
CAS
94158-60-8
Created by admin on Sat Dec 16 11:58:26 GMT 2023 , Edited by admin on Sat Dec 16 11:58:26 GMT 2023
PRIMARY
FDA UNII
VSP82YH5EK
Created by admin on Sat Dec 16 11:58:26 GMT 2023 , Edited by admin on Sat Dec 16 11:58:26 GMT 2023
PRIMARY
EPA CompTox
DTXSID50240838
Created by admin on Sat Dec 16 11:58:26 GMT 2023 , Edited by admin on Sat Dec 16 11:58:26 GMT 2023
PRIMARY
ECHA (EC/EINECS)
303-131-4
Created by admin on Sat Dec 16 11:58:26 GMT 2023 , Edited by admin on Sat Dec 16 11:58:26 GMT 2023
PRIMARY