Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C10H13NO3.ClH.H2O |
| Molecular Weight | 249.691 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.Cl.CNC1=C(OC)C=CC=C1C(=O)OC
InChI
InChIKey=YFHNXFPDIQHHQC-UHFFFAOYSA-N
InChI=1S/C10H13NO3.ClH.H2O/c1-11-9-7(10(12)14-3)5-4-6-8(9)13-2;;/h4-6,11H,1-3H3;1H;1H2
| 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 | C10H13NO3 |
| Molecular Weight | 195.2151 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| 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 18:43:58 GMT 2025
by
admin
on
Mon Mar 31 18:43:58 GMT 2025
|
| Record UNII |
3V8D3WXV0A
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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Preferred Name | English | ||
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71586837
Created by
admin on Mon Mar 31 18:43:58 GMT 2025 , Edited by admin on Mon Mar 31 18:43:58 GMT 2025
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3V8D3WXV0A
Created by
admin on Mon Mar 31 18:43:58 GMT 2025 , Edited by admin on Mon Mar 31 18:43:58 GMT 2025
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DTXSID30208577
Created by
admin on Mon Mar 31 18:43:58 GMT 2025 , Edited by admin on Mon Mar 31 18:43:58 GMT 2025
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5986-11-8
Created by
admin on Mon Mar 31 18:43:58 GMT 2025 , Edited by admin on Mon Mar 31 18:43:58 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
ANHYDROUS->SOLVATE |
