Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C19H19F23NO3.I |
| Molecular Weight | 873.2268 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[I-].C[N+](CCO)(CCO)CC(O)CC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(C(F)(F)F)C(F)(F)F
InChI
InChIKey=ACIXJWKFKMGNIK-UHFFFAOYSA-M
InChI=1S/C19H19F23NO3.HI/c1-43(2-4-44,3-5-45)7-8(46)6-9(20,21)11(23,24)13(27,28)15(31,32)17(35,36)16(33,34)14(29,30)12(25,26)10(22,18(37,38)39)19(40,41)42;/h8,44-46H,2-7H2,1H3;1H/q+1;/p-1
| Molecular Formula | C19H19F23NO3 |
| Molecular Weight | 746.3223 |
| Charge | 1 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 2 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
| Molecular Formula | I |
| Molecular Weight | 126.90447 |
| 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
Edited
Wed Apr 02 19:35:26 GMT 2025
by
admin
on
Wed Apr 02 19:35:26 GMT 2025
|
| Record UNII |
W35E2Q2TFK
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| Record Status |
Validated (UNII)
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| Record Version |
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-
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94159-77-0
Created by
admin on Wed Apr 02 19:35:26 GMT 2025 , Edited by admin on Wed Apr 02 19:35:26 GMT 2025
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W35E2Q2TFK
Created by
admin on Wed Apr 02 19:35:26 GMT 2025 , Edited by admin on Wed Apr 02 19:35:26 GMT 2025
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21149802
Created by
admin on Wed Apr 02 19:35:26 GMT 2025 , Edited by admin on Wed Apr 02 19:35:26 GMT 2025
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DTXSID90881148
Created by
admin on Wed Apr 02 19:35:26 GMT 2025 , Edited by admin on Wed Apr 02 19:35:26 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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![Structure of [Bis(2-hydroxyethyl)][2-hydroxy-4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,13,13,13-icosafluoro-12-(trifluoromethyl)tridecan-1-yl]methylammonium](/img/ceb37937-f47a-427d-a97d-949df20904a7.svg "Structure of [Bis(2-hydroxyethyl)][2-hydroxy-4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,13,13,13-icosafluoro-12-(trifluoromethyl)tridecan-1-yl]methylammonium")