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Acetic Acid → Tetraethyl 3-benzylaminopentane-1,1-bisphosphonate

HRID 159374
노트
인쇄 미리보기

반응식

HRID 159374 반응식
[Br:23][c:24]1[c:25]([OH:26])[c:27]([CH:28]([CH3:29])[CH3:30])[cH:31][cH:32][c:33]1[CH3:34].[CH3:43][C:44](=[O:45])[OH:46].[CH3:47][OH:48].[NH2:35][CH2:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1.[O:1]=[C:2]([CH2:3][CH:4]([P:5]([O:6][CH2:7][CH3:8])(=[O:9])[O:10][CH2:11][CH3:12])[P:13]([O:14][CH2:15][CH3:16])(=[O:17])[O:18][CH2:19][CH3:20])[CH2:21][CH3:22]>>[CH:2]([CH2:3][CH:4]([P:5]([O:6][CH2:7][CH3:8])(=[O:9])[O:10][CH2:11][CH3:12])[P:13]([O:14][CH2:15][CH3:16])(=[O:17])[O:18][CH2:19][CH3:20])([CH2:21][CH3:22])[NH:35][CH2:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 176Acetic AcidHCID 887MethanolHCID 7504BenzylamineHCID 12499407Tetraethyl 3-oxopentane-1,1-bisphosphonateHCID 130677722-Bromo-6-isopropyl-3-methylphenol

생성물 1

HCID 19689047Tetraethyl 3-benzylaminopentane-1,1-bisphosphonate

출처 및 근거

ORD 기록
ord-9bedc236155446d5a1daef4ac898e7c6
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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