Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C13H19NO2.BrH.H2O |
| Molecular Weight | 320.223 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.Br.COC1=CC2=C(C=C1OC)C(C)N(C)CC2
InChI
InChIKey=VIOSAWVADFUWIT-UHFFFAOYSA-N
InChI=1S/C13H19NO2.BrH.H2O/c1-9-11-8-13(16-4)12(15-3)7-10(11)5-6-14(9)2;;/h7-9H,5-6H2,1-4H3;1H;1H2
| Molecular Formula | BrH |
| Molecular Weight | 80.912 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C13H19NO2 |
| Molecular Weight | 221.2955 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
| 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 |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 09:13:34 UTC 2023
by
admin
on
Sat Dec 16 09:13:34 UTC 2023
|
| Record UNII |
T39LM95QHX
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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T39LM95QHX
Created by
admin on Sat Dec 16 09:13:34 UTC 2023 , Edited by admin on Sat Dec 16 09:13:34 UTC 2023
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72941464
Created by
admin on Sat Dec 16 09:13:34 UTC 2023 , Edited by admin on Sat Dec 16 09:13:34 UTC 2023
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5853-25-8
Created by
admin on Sat Dec 16 09:13:34 UTC 2023 , Edited by admin on Sat Dec 16 09:13:34 UTC 2023
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m3117
Created by
admin on Sat Dec 16 09:13:34 UTC 2023 , Edited by admin on Sat Dec 16 09:13:34 UTC 2023
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PRIMARY | Merck Index |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
ANHYDROUS->SOLVATE |
