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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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Acetic Acid → 4-(5-Cyclopropylamino-8,8-dimethyl-5,6,7,8-tetrahydro-naphthalene-2-ylethynyl)-benzoic acid ethyl ester

HRID 819615
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인쇄 미리보기

반응식

HRID 819615 반응식
[C:35]([BH3-:36])#[N:37].[CH2:1]([CH3:2])[O:3][C:4]([c:5]1[cH:6][cH:7][c:8]([C:11]#[C:12][c:13]2[cH:14][c:15]3[c:20]([cH:21][cH:22]2)[C:19](=[O:23])[CH2:18][CH2:17][C:16]3([CH3:24])[CH3:25])[cH:9][cH:10]1)=[O:26].[CH3:31][C:32](=[O:33])[OH:34].[CH3:42][C:43]#[N:44].[CH:27]1([NH2:30])[CH2:28][CH2:29]1.[Cl:39][CH2:40][Cl:41].[Na+:38].[Na+:46].[Na+:47].[O-:48][C:49](=[O:50])[O-:51].[OH2:45]>>[CH2:1]([CH3:2])[O:3][C:4]([c:5]1[cH:6][cH:7][c:8]([C:11]#[C:12][c:13]2[cH:14][c:15]3[c:20]([cH:21][cH:22]2)[CH:19]([NH:30][CH:27]2[CH2:28][CH2:29]2)[CH2:18][CH2:17][C:16]3([CH3:24])[CH3:25])[cH:9][cH:10]1)=[O:26]
참가 물질출처 및 근거반응 노트

참가 물질

10

반응물 9

HCID 176Acetic AcidHCID 923Sodium Ion3회HCID 962WaterHCID 6342AcetonitrileHCID 6344DichloromethaneHCID 19660Carbonate IonHCID 69828CyclopropylamineHCID 498716Cyano-borohydride
HCID 15345545
Ethyl 4-[(5,6,7,8-tetrahydro-8,8-dimethyl-5-oxonaphth-2-yl)ethynyl]benzoate

생성물 1

HCID 129717084-(5-Cyclopropylamino-8,8-dimethyl-5,6,7,8-tetrahydro-naphthalene-2-ylethynyl)-benzoic acid ethyl ester

출처 및 근거

ORD 기록
ord-c2070c418ce0478e9e0ab709f7695b7b
출처 데이터셋
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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