Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C10H8ClO3.Na.H2O |
| Molecular Weight | 252.627 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.[Na+].OC(\C=C\C([O-])=O)C1=CC=C(Cl)C=C1
InChI
InChIKey=NZFKWKOBJBRWMV-TXOOBNKBSA-M
InChI=1S/C10H9ClO3.Na.H2O/c11-8-3-1-7(2-4-8)9(12)5-6-10(13)14;;/h1-6,9,12H,(H,13,14);;1H2/q;+1;/p-1/b6-5+;;
Approval Year
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| Code System | Code | Type | Description | ||
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1049737-99-6
Created by
admin on Sat Dec 16 07:56:40 UTC 2023 , Edited by admin on Sat Dec 16 07:56:40 UTC 2023
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P95V0G7WIZ
Created by
admin on Sat Dec 16 07:56:40 UTC 2023 , Edited by admin on Sat Dec 16 07:56:40 UTC 2023
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16219744
Created by
admin on Sat Dec 16 07:56:40 UTC 2023 , Edited by admin on Sat Dec 16 07:56:40 UTC 2023
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DTXSID7045786
Created by
admin on Sat Dec 16 07:56:40 UTC 2023 , Edited by admin on Sat Dec 16 07:56:40 UTC 2023
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PRIMARY |
ACTIVE MOIETY
SUBSTANCE RECORD