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Acetone → 2-[[Bis(allyloxy)phosphoryl]oxymethyl]-3-methoxybenzoic acid

HRID 177456
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HRID 177456 반응식
[CH3:54][N:55]([CH3:56])[CH:57]=[O:58].[CH3:59][C:60](=[O:61])[CH3:62].[CH3:64][CH:65]([OH:66])[CH3:67].[Cr:23](=[O:24])([O:25][Cr:26]([O-:27])(=[O:28])=[O:29])([O-:30])=[O:31].[Cr:44]([OH:45])([OH:46])(=[O:47])=[O:48].[OH2:63].[P:1](=[O:2])([O:3][CH2:4][CH:5]=[CH2:6])([O:7][CH2:8][CH:9]=[CH2:10])[O:11][CH2:12][c:13]1[c:14]([CH2:21][OH:22])[cH:15][cH:16][cH:17][c:18]1[O:19][CH3:20].[S:49](=[O:50])(=[O:51])([OH:52])[OH:53].[nH+:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1.[nH+:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1>>[P:1](=[O:2])([O:3][CH2:4][CH:5]=[CH2:6])([O:7][CH2:8][CH:9]=[CH2:10])[O:11][CH2:12][c:13]1[c:14]([C:21](=[O:22])[OH:24])[cH:15][cH:16][cH:17][c:18]1[O:19][CH3:20]
참가 물질출처 및 근거반응 노트

참가 물질

10

반응물 9

HCID 180AcetoneHCID 962WaterHCID 1118Sulfuric AcidHCID 3776IsopropanolHCID 6228DimethylformamideHCID 24425Chromic AcidHCID 24503Dichromate ionHCID 4989215Pyridinium2회
HCID 17862616Diallyl 2-(hydroxymethyl)-6-methoxybenzyl phosphate

생성물 1

HCID 178625362-[[Bis(allyloxy)phosphoryl]oxymethyl]-3-methoxybenzoic acid

출처 및 근거

ORD 기록
ord-2ba09d385bd3415796cc738fdeed18fb
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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