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Hydrogen Peroxide → 2-[4-(Oxiran-2-ylmethyl)phenyl]-7-propan-2-yl-1,3-benzoxazole-5-carbonitrile

HRID 94934
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HRID 94934 반응식
[CH2:1]([CH:2]=[CH2:3])[c:4]1[cH:5][cH:6][c:7](-[c:10]2[o:11][c:12]3[c:13]([n:14]2)[cH:15][c:16]([C:22]#[N:23])[cH:17][c:18]3[CH:19]([CH3:20])[CH3:21])[cH:8][cH:9]1.[CH2:36]([Cl:37])[Cl:38].[CH3:24][C:25]#[N:26].[K+:34].[K+:35].[OH:27][OH:28].[P:29](=[O:30])([O-:31])([O-:32])[OH:33]>>[CH2:1]([CH:2]1[CH2:3][O:30]1)[c:4]1[cH:5][cH:6][c:7](-[c:10]2[o:11][c:12]3[c:13]([n:14]2)[cH:15][c:16]([C:22]#[N:23])[cH:17][c:18]3[CH:19]([CH3:20])[CH3:21])[cH:8][cH:9]1
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 784Hydrogen PeroxideHCID 813Potassium Cation2회HCID 6342AcetonitrileHCID 6344DichloromethaneHCID 3681305Hydrogen phosphateHCID 671408347-Propan-2-yl-2-(4-prop-2-enylphenyl)-1,3-benzoxazole-5-carbonitrile

생성물 1

HCID 866351282-[4-(Oxiran-2-ylmethyl)phenyl]-7-propan-2-yl-1,3-benzoxazole-5-carbonitrile

출처 및 근거

ORD 기록
ord-6d95c3e87c314deeb534a35bc385834f
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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