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Hydrochloric Acid → 9-Cyano-4,5-dihydro-6-oxa-3-thia-1-aza-benzo[e]azulene-2-carboxylic acid

HRID 115874
Notes
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Reaction equation

HRID 115874 reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[s:7][c:8]2[c:14]([n:15]1)-[c:13]1[c:12]([cH:19][cH:18][c:17]([C:20]#[N:21])[cH:16]1)[O:11][CH2:10][CH2:9]2.[CH2:25]1[O:26][CH2:27][CH2:28][CH2:29]1.[CH3:30][CH2:31][OH:32].[ClH:24].[Na+:23].[OH-:22]>>[O:3]=[C:4]([OH:5])[c:6]1[s:7][c:8]2[c:14]([n:15]1)-[c:13]1[c:12]([cH:19][cH:18][c:17]([C:20]#[N:21])[cH:16]1)[O:11][CH2:10][CH2:9]2
ParticipantsSources & evidenceReaction notes

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 702EthanolHCID 923Sodium IonHCID 961HydroxideHCID 8028TetrahydrofuranHCID 668686059-Cyano-4,5-dihydro-6-oxa-3-thia-1-aza-benzo[e]azulene-2-carboxylic acid ethyl ester

Product 1

HCID 866348519-Cyano-4,5-dihydro-6-oxa-3-thia-1-aza-benzo[e]azulene-2-carboxylic acid

Sources & evidence

ORD record
ord-8e8b735f18b3494291a72bf007726708
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

Reaction notes

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