Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C12H16F3N.ClH |
Molecular Weight | 267.718 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.CCN[C@@H](C)CC1=CC=CC(=C1)C(F)(F)F
InChI
InChIKey=ZXKXJHAOUFHNAS-FVGYRXGTSA-N
InChI=1S/C12H16F3N.ClH/c1-3-16-9(2)7-10-5-4-6-11(8-10)12(13,14)15;/h4-6,8-9,16H,3,7H2,1-2H3;1H/t9-;/m0./s1
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 |
Molecular Formula | C12H16F3N |
Molecular Weight | 231.2573 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:59:25 UTC 2023
by
admin
on
Fri Dec 15 15:59:25 UTC 2023
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Record UNII |
PM28L0FHNP
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Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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DEA NO. |
1670
Created by
admin on Fri Dec 15 15:59:25 UTC 2023 , Edited by admin on Fri Dec 15 15:59:25 UTC 2023
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NCI_THESAURUS |
C29728
Created by
admin on Fri Dec 15 15:59:25 UTC 2023 , Edited by admin on Fri Dec 15 15:59:25 UTC 2023
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NCI_THESAURUS |
C47794
Created by
admin on Fri Dec 15 15:59:25 UTC 2023 , Edited by admin on Fri Dec 15 15:59:25 UTC 2023
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Code System | Code | Type | Description | ||
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CHEMBL248702
Created by
admin on Fri Dec 15 15:59:25 UTC 2023 , Edited by admin on Fri Dec 15 15:59:25 UTC 2023
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PRIMARY | |||
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3239-45-0
Created by
admin on Fri Dec 15 15:59:25 UTC 2023 , Edited by admin on Fri Dec 15 15:59:25 UTC 2023
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PRIMARY | |||
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DD-52
Created by
admin on Fri Dec 15 15:59:25 UTC 2023 , Edited by admin on Fri Dec 15 15:59:25 UTC 2023
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DTXSID7048871
Created by
admin on Fri Dec 15 15:59:25 UTC 2023 , Edited by admin on Fri Dec 15 15:59:25 UTC 2023
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100000087765
Created by
admin on Fri Dec 15 15:59:25 UTC 2023 , Edited by admin on Fri Dec 15 15:59:25 UTC 2023
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m5274
Created by
admin on Fri Dec 15 15:59:25 UTC 2023 , Edited by admin on Fri Dec 15 15:59:25 UTC 2023
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PRIMARY | Merck Index | ||
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155142
Created by
admin on Fri Dec 15 15:59:25 UTC 2023 , Edited by admin on Fri Dec 15 15:59:25 UTC 2023
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59730
Created by
admin on Fri Dec 15 15:59:25 UTC 2023 , Edited by admin on Fri Dec 15 15:59:25 UTC 2023
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C75111
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admin on Fri Dec 15 15:59:25 UTC 2023 , Edited by admin on Fri Dec 15 15:59:25 UTC 2023
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66264
Created by
admin on Fri Dec 15 15:59:25 UTC 2023 , Edited by admin on Fri Dec 15 15:59:25 UTC 2023
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SUB01629MIG
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admin on Fri Dec 15 15:59:25 UTC 2023 , Edited by admin on Fri Dec 15 15:59:25 UTC 2023
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221-806-0
Created by
admin on Fri Dec 15 15:59:25 UTC 2023 , Edited by admin on Fri Dec 15 15:59:25 UTC 2023
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PM28L0FHNP
Created by
admin on Fri Dec 15 15:59:25 UTC 2023 , Edited by admin on Fri Dec 15 15:59:25 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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RACEMATE -> ENANTIOMER | |||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |