Methyl 3-methoxy-2-[2-(2-isopropoxy-6-trifluoromethylpyrimidin-4-yloxymethyl) phenyl]acrylate

HCID 53395020

기본 정보

표준 SMILES
COC=C(C(=O)OC)c1ccccc1COc1cc(C(F)(F)F)nc(OC(C)C)n1
InChIKey
MXWAGQASUDSFBG-UHFFFAOYSA-N
분자식
C20H21F3N2O5
평균 분자량
426.4 g/mol
단동위원소 질량
426.14025643

이름 및 식별자

우선 이름
Methyl 3-methoxy-2-[2-(2-isopropoxy-6-trifluoromethylpyrimidin-4-yloxymethyl) phenyl]acrylate
IUPAC
methyl 3-methoxy-2-[2-[[2-propan-2-yloxy-6-(trifluoromethyl)pyrimidin-4-yl]oxymethyl]phenyl]prop-2-enoate

이름 및 동의어

methyl 3-methoxy-2-[2-(2-isopropoxy-6-trifluoromethylpyrimidin-4-yloxymethyl) phenyl]acrylateFluacyrpyrimSCHEMBL5997532DTXSID50870270DB-046047methyl 3-methoxy-2-[2-(2-isopropoxy-6-trifluoromethylpyrimidin4-yloxymethyl)phenyl]acrylate(|AE)-|A-(Methoxymethylene-2-[[[2-(1-methylethoxy)-6-(trifluoromethyl)-4-pyrimidinyl]oxy]methyl]-benzeneacetic acid methyl esterMethyl (E)-2-{|A-[2-isopropoxy-6-(trifluoromethyl)pyrimidin-4-yloxy]-o-tolyl}-3-methoxyacrylatemethyl 3-methoxy-2-(2-((2-isopropoxy-6-trifluoromethyl pyrimidine-4-yl)oxymethyl)phenyl)acrylatemethyl 3-methoxy-2-[2-(2-isopropoxy-6-trifluoromethylpyrimidin-4-yloxymethyl)phenyl]acrylateMethyl 3-methoxy-2-[2-(2-isopropoxy-6-trifluoromethylpyrimidine-4-yloxymethyl) phenyl]acrylatemethyl 3-methoxy-2-[2-(2-isopropoxy-6-trifluoromethylpyrimidine-4-yloxymethyl)phenyl]acrylate
이름 더 보기
Methyl 3-methoxy-2-{2-[({2-[(propan-2-yl)oxy]-6-(trifluoromethyl)pyrimidin-4-yl}oxy)methyl]phenyl}prop-2-enoate

데이터베이스 식별자

PubChem CID
53395020
DTXSID
DTXSID50870270

물성

구조 계산 물성

XLogP
4.1
극성 표면적
79.8 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
10
회전 가능 결합 수
9
무거운 원자 수
30

관련 반응

10건

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