Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C9H13NO2.BrH |
| Molecular Weight | 248.117 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Br.CNCCC1=CC=C(O)C(O)=C1
InChI
InChIKey=ACICAVVXAAEHEM-UHFFFAOYSA-N
InChI=1S/C9H13NO2.BrH/c1-10-5-4-7-2-3-8(11)9(12)6-7;/h2-3,6,10-12H,4-5H2,1H3;1H
| 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 | C9H13NO2 |
| Molecular Weight | 167.205 |
| 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 19:48:10 UTC 2023
by
admin
on
Sat Dec 16 19:48:10 UTC 2023
|
| Record UNII |
J9AP3NQW36
|
| Record Status |
Validated (UNII)
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| Record Version |
|
-
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18191-22-5
Created by
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19794533
Created by
admin on Sat Dec 16 19:48:10 UTC 2023 , Edited by admin on Sat Dec 16 19:48:10 UTC 2023
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J9AP3NQW36
Created by
admin on Sat Dec 16 19:48:10 UTC 2023 , Edited by admin on Sat Dec 16 19:48:10 UTC 2023
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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