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Methanol → Butanedioic acid, 2-methyl-, 1,4-dimethyl ester

HRID 172154
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HRID 172154 반응식
[B-:14]([F:15])([F:16])([F:17])[F:18].[C:1]([C:2](=[CH2:3])[CH2:4][C:5](=[O:6])[O:7][CH3:8])(=[O:9])[O:10][CH3:11].[CH3:69][OH:70].[CH:20]1=[CH:27][CH2:26][CH2:25][CH:24]=[CH:23][CH2:22][CH2:21]1.[H:12][H:13].[Rh+:19].[c:28]1([CH:29]2[CH2:30][CH2:31][CH:32]([c:33]3[cH:34][cH:35][cH:36][cH:37][cH:38]3)[P:39]2[C:40]2=[C:46]([P:47]3[CH:48]([c:49]4[cH:50][cH:51][cH:52][cH:53][cH:54]4)[CH2:55][CH2:56][CH:57]3[c:58]3[cH:59][cH:60][cH:61][cH:62][cH:63]3)[C:44](=[O:45])[O:43][C:41]2=[O:42])[cH:64][cH:65][cH:66][cH:67][cH:68]1>>[C:1]([CH:2]([CH3:3])[CH2:4][C:5](=[O:6])[O:7][CH3:8])(=[O:9])[O:10][CH3:11]
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 887MethanolHCID 8135cis,cis-1,5-CyclooctadieneHCID 26255TetrafluoroborateHCID 69240Dimethyl itaconateHCID 873065253,4-Bis(2,5-diphenylphospholan-1-yl)furan-2,5-dioneHCID 178418361HCID 178418361, 화합물HCID 178527705HCID 178527705, 화합물

생성물 1

HCID 15350Butanedioic acid, 2-methyl-, 1,4-dimethyl ester

출처 및 근거

ORD 기록
ord-3b28ccf7641046348755e3ad054b4658
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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