Bicarbonate Ion → HCID 86617086, compound

HRID 1118212Notes

Reaction equation

HRID 1118212 reaction equation
[C:76](=[O:77])([OH:78])[O-:79].[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][C:6](=[O:7])[c:8]1[n:9][c:10]([OH:35])[c:11]2[cH:12][cH:13][c:14]([O:19][c:20]3[cH:21][c:22]4[c:23]([n:24][c:25]([N:27]5[CH2:28][CH2:29][O:30][CH2:31][CH2:32]5)[s:26]4)[cH:33][cH:34]3)[cH:15][c:16]2[c:17]1[OH:18].[CH2:36]([O:37][C:38]([c:39]1[n:40][c:41]([OH:42])[c:43]2[c:44]([c:45]1[OH:46])[cH:47][cH:48][c:49]([O:50][c:51]1[cH:52][cH:53][c:54]3[n:55][c:56]([N:57]4[CH2:58][CH2:59][O:60][CH2:61][CH2:62]4)[s:63][c:64]3[cH:65]1)[cH:66]2)=[O:67])[CH2:68][CH2:69][CH3:70].[Cl:81][CH:82]([Cl:83])[CH3:84].[Na+:80].[P:71]([Cl:72])([Cl:73])([Cl:74])=[O:75]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][C:6](=[O:7])[c:8]1[n:9][c:10]([Cl:73])[c:11]2[cH:12][cH:13][c:14]([O:19][c:20]3[cH:21][c:22]4[c:23]([n:24][c:25]([N:27]5[CH2:28][CH2:29][O:30][CH2:31][CH2:32]5)[s:26]4)[cH:33][cH:34]3)[cH:15][c:16]2[c:17]1[OH:18]

Participants

7

Reactant 6

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 63651,1-DichloroethaneHCID 24813Phosphorus oxychlorideHCID 178450847HCID 178450847, compoundHCID 178450855HCID 178450855, compound

Product 1

HCID 86617086HCID 86617086, compound

Sources & evidence

ORD record
ord-5da112f4f4864844a8509b58e0141320
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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