T-부틸2-(트리플루오로메틸)아크릴레이트

tert-Butyl 2-(trifluoromethyl)acrylate

HCID 2782282

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 105935-24-8
표준 SMILES: C=C(C(=O)OC(C)(C)C)C(F)(F)F
InChIKey: RCSSZBOUAGQERK-UHFFFAOYSA-N
분자식: C8H11F3O2
평균 분자량: 196.17 g/mol
단동위원소 질량: 196.07111425

이름 및 식별자

우선 이름: tert-Butyl 2-(trifluoromethyl)acrylate
IUPAC: tert-butyl 2-(trifluoromethyl)prop-2-enoate
현지명: T-부틸2-(트리플루오로메틸)아크릴레이트
영어명: T-BUTYL 2-(TRIFLUOROMETHYL)ACRYLATE
분자식: C8H11F3O2
분자량: 196.17

이름 및 동의어

tert-Butyl 2-(trifluoromethyl)acrylate105935-24-8DTXSID20382017RefChem:383186DTXCID00333042696-305-7tert-butyl 2-(trifluoromethyl)prop-2-enoatet-Butyl 2-(trifluoromethyl)acrylateT-BUTYL2-(TRIFLUOROMETHYL)ACRYLATEMFCD040382752-Propenoic acid,2-(trifluoromethyl)-, 1,1-dimethylethyl estertert-Butyl2-(trifluoromethyl)acrylate

이름 더 보기

T-부틸2-(트리플루오로메틸)아크릴레이트tert-Butyl2-(trifluoromethyl)acrylate98%2-(Trifluoromethyl)acrylic acid tert-butyl esteralpha-Trifluoromethylacrylic acid-tert-butylesterTFMA-B, tert-Butyl 2-(trifluoromethyl)prop-2-enoatetert-Butyl 2-(trifluoromethyl)acrylate,97%,stabilized with 0.025% 4-hydroxyTEMPO

SCHEMBL1964962-Propenoic acid, 2-(trifluoromethyl)-, 1,1-dimethylethyl esterSBB091974AKOS005063522BS-25736SY269118DB-001429CS-0206152

데이터베이스 식별자

CAS: 105935-24-8
PubChem CID: 2782282
DTXSID: DTXSID20382017
EC Number: 696-305-7
Nikkaji: J1.607.849B

물성

구조 계산 물성

XLogP: 2.6
극성 표면적: 26.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 5
회전 가능 결합 수: 3
무거운 원자 수: 13
형식 전하: 0
복잡도: 223

물리화학적 성질

끓는 점: 174 ℃ · 174℃
밀도: 1.118 · 1.118
인화점: 37 ℃ · 37℃
저장 조건: 2 · 2-8°C, stored under nitrogen
물리적 상태: 액체
색상: 연노랑
InChI: InChI=1S/C8H11F3O2/c1-5(8(9,10)11)6(12)13-7(2,3)4/h1H2,2-4H3
InChIKey: RCSSZBOUAGQERK-UHFFFAOYSA-N
SMILES: C(OC(C)(C)C)(=O)C(C(F)(F)F)=C

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H226 (50%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.