Dichloromethane → HCID 72244005, compound

HRID 1535221Notes

Reaction equation

HRID 1535221 reaction equation
[CH:71]([N:72]([CH2:73][CH3:74])[CH:75]([CH3:76])[CH3:77])([CH3:78])[CH3:79].[Cl:80][CH2:81][Cl:82].[Cl:8][c:9]1[c:10]([F:38])[c:11]([CH:15]2[CH:16]([C:35](=[O:36])[OH:37])[NH:17][CH:18]([CH2:30][C:31]([CH3:32])([CH3:33])[CH3:34])[C:19]2([C:20]#[N:21])[c:22]2[c:23]([F:29])[cH:24][c:25]([Cl:28])[cH:26][cH:27]2)[cH:12][cH:13][cH:14]1.[F:1][C:2]([F:3])([F:4])[C:5]([OH:6])=[O:7].[NH2:39][c:40]1[n:41][n:42][c:43]([Cl:46])[cH:44][cH:45]1.[P-:47]([F:48])([F:49])([F:50])([F:51])([F:52])[F:53].[n:54]1([O:55][C:56]([N:57]([CH3:58])[CH3:59])=[N+:60]([CH3:61])[CH3:62])[c:63]2[n:64][cH:65][cH:66][cH:67][c:68]2[n:69][n:70]1>>[Cl:8][c:9]1[c:10]([F:38])[c:11]([CH:15]2[CH:16]([C:35](=[O:36])[NH:39][c:40]3[n:41][n:42][c:43]([Cl:46])[cH:44][cH:45]3)[NH:17][CH:18]([CH2:30][C:31]([CH3:32])([CH3:33])[CH3:34])[C:19]2([C:20]#[N:21])[c:22]2[c:23]([F:29])[cH:24][c:25]([Cl:28])[cH:26][cH:27]2)[cH:12][cH:13][cH:14]1

Participants

8

Reactant 7

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 9886HexafluorophosphateHCID 216436-Amino-3-chloropyridazineHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 666882513-(3-Chloro-2-fluoro-phenyl)-4-(4-chloro-2-fluoro-phenyl)-4-cyano-5-(2,2-dimethyl-propyl)-pyrrolidine-2-carboxylic acid

Product 1

HCID 72244005HCID 72244005, compound

Sources & evidence

ORD record
ord-36aed5ea10364bf89a5c5031f685952b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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