메틸(E)-3-플루오로신나메이트

Methyl (E)-3-fluorocinnamate

HCID 13415099

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 74325-03-4
표준 SMILES: COC(=O)/C=C/c1cccc(F)c1
InChIKey: FLDMXKIURVHYKV-AATRIKPKSA-N
분자식: C10H9FO2
평균 분자량: 180.17 g/mol

이름 및 식별자

우선 이름: Methyl (E)-3-fluorocinnamate
IUPAC: methyl (E)-3-(3-fluorophenyl)prop-2-enoate
현지명: 메틸(E)-3-플루오로신나메이트
영어명: METHYL (E)-3-FLUOROCINNAMATE
분자식: C10H9FO2
분자량: 180.18

이름 및 동의어

74325-03-4methyl (e)-3-fluorocinnamateRefChem:812403813-380-5(e)-methyl 3-(3-fluorophenyl)acrylatemethyl (2E)-3-(3-fluorophenyl)prop-2-enoateMFCD07784271methyl (E)-3-(3-fluorophenyl)prop-2-enoatemethyl 3-(3-fluorophenyl)prop-2-enoateMethyl 3-fluorocinnamateMethyl 3-(3-fluorophenyl)acrylatemethyl trans-3-fluorocinnamate

이름 더 보기

메틸(E)-3-플루오로신나메이트Methyl (E)-3-(3-fluorophenyl)acrylate-Methyl 3-(3-fluorophenyl)(E)-3-Fluorocinnamicacidmethylester4-[(3-fluorophenyl)methoxy]-2-methylbenzoate2-Propenoic acid, 3-(3-fluorophenyl)-, methyl ester, (2E)-Methyl (E)-3-(3-fluorophenyl)acrylate, Methyl (2E)-3-(3-fluorophenyl)prop-2-enoate

Methyl-(E)-3-fluorocinnamateSCHEMBL1431912SCHEMBL8697109SCHEMBL30098502FLDMXKIURVHYKV-AATRIKPKSA-NSBB089651AKOS006229949PS-6535

데이터베이스 식별자

CAS: 74325-03-4
PubChem CID: 13415099
EC Number: 813-380-5
Nikkaji: J2.595.072K、J955.568D

물성

구조 계산 물성

XLogP: 2.3
극성 표면적: 26.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 3
무거운 원자 수: 13
형식 전하: 0
복잡도: 201

물리화학적 성질

끓는 점: 133 · 133-134°C/17mm
밀도: 1.165 · 1.165±0.06 g/cm3(Predicted)
인화점: 110 ° · >110°
물리적 상태: 액체
색상: 투명한

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.