Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C6H12F2N2O2.ClH.H2O |
| Molecular Weight | 236.645 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.Cl.NCCC[C@@](N)(C(F)F)C(O)=O
InChI
InChIKey=FJPAMFNRCFEGSD-QYCVXMPOSA-N
InChI=1S/C6H12F2N2O2.ClH.H2O/c7-4(8)6(10,5(11)12)2-1-3-9;;/h4H,1-3,9-10H2,(H,11,12);1H;1H2/t6-;;/m1../s1
| Molecular Formula | H2O |
| Molecular Weight | 18.0153 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C6H12F2N2O2 |
| Molecular Weight | 182.1685 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | ClH |
| Molecular Weight | 36.461 |
| 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
Edited
Mon Mar 31 23:40:09 GMT 2025
by
admin
on
Mon Mar 31 23:40:09 GMT 2025
|
| Record UNII |
M3O9BB413G
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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Preferred Name | English | ||
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Common Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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M3O9BB413G
Created by
admin on Mon Mar 31 23:40:09 GMT 2025 , Edited by admin on Mon Mar 31 23:40:09 GMT 2025
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PRIMARY | |||
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69955-42-6
Created by
admin on Mon Mar 31 23:40:09 GMT 2025 , Edited by admin on Mon Mar 31 23:40:09 GMT 2025
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23393214
Created by
admin on Mon Mar 31 23:40:09 GMT 2025 , Edited by admin on Mon Mar 31 23:40:09 GMT 2025
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PRIMARY |
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|---|---|---|---|---|
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RACEMATE -> ENANTIOMER |