Ethyl ethoxymethylene-3-oxo-4,4,4-trifluorobutyrate

HCID 6185754

기본 정보

표준 SMILES
CCO/C=C(/C(=O)OCC)C(=O)C(F)(F)F
InChIKey
XNGGOXOLHQANRB-AATRIKPKSA-N
분자식
C9H11F3O4
평균 분자량
240.18 g/mol
단동위원소 질량
240.06094331

이름 및 식별자

우선 이름
Ethyl ethoxymethylene-3-oxo-4,4,4-trifluorobutyrate
IUPAC
ethyl (2E)-2-(ethoxymethylidene)-4,4,4-trifluoro-3-oxobutanoate

이름 및 동의어

ethyl ethoxymethylene-3-oxo-4,4,4-trifluorobutyrateEthyl 2-(ethoxymethylene)-4,4,4-trifluoroacetoacetateethyl (2E)-2-(ethoxymethylidene)-4,4,4-trifluoro-3-oxobutanoate(E)-ethyl 2-(ethoxymethylene)-4,4,4-trifluoro-3-oxobutanoateMFCD02677683Ethyl (E)-2-(ethoxymethylene)-4,4,4-trifluoro-3-oxobutanoateethyl 3-ethoxy-2-(2,2,2-trifluoroacetyl)acrylate1307815-48-0SCHEMBL251634SBB099234AKOS009124416FE105844
이름 더 보기
CS-0130603EN300-276935W-1080F008919ethyl2-(ethoxymethylene)-4,4,4-trifluoro-3-oxobutyrate(E)-ethyl2-(ethoxymethylene)-4,4,4-trifluoro-3-oxobutanoateethyl (2E)-3-ethoxy-2-(2,2,2-trifluoroacetyl)prop-2-enoateethyl (E)-3-ethoxy-2-(2,2,2-trifluoroacetyl)-2-propenoate

데이터베이스 식별자

PubChem CID
6185754
Nikkaji
J645.781I

물성

구조 계산 물성

XLogP
2.1
극성 표면적
52.6 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
7
회전 가능 결합 수
6
무거운 원자 수
16

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5건

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