2,2-디플루오로벤조디옥솔-5-카르복스알데히드

2,2-Difluoro-5-formylbenzodioxole

HCID 2736973

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 656-42-8
표준 SMILES: O=Cc1ccc2c(c1)OC(F)(F)O2
InChIKey: GGERGLKEDUUSAP-UHFFFAOYSA-N
분자식: C8H4F2O3
평균 분자량: 186.11 g/mol
단동위원소 질량: 186.01285043

이름 및 식별자

우선 이름: 2,2-Difluoro-5-formylbenzodioxole
IUPAC: 2,2-difluoro-1,3-benzodioxole-5-carbaldehyde
현지명: 2,2-디플루오로벤조디옥솔-5-카르복스알데히드
영어명: 2,2-Difluorobenzodioxole-5-carboxaldehyde
분자식: C8H4F2O3
분자량: 186.11

이름 및 동의어

2,2-Difluoro-5-formylbenzodioxoleRefChem:441089627-939-4656-42-82,2-Difluorobenzo[d][1,3]dioxole-5-carbaldehyde2,2-Difluorobenzodioxole-5-carboxaldehyde2,2-Difluoro-1,3-benzodioxole-5-carboxaldehyde2,2-difluoro-1,3-benzodioxole-5-carbaldehyde2,2-difluoro-2H-1,3-benzodioxole-5-carbaldehydeMFCD00792420SCHEMBL497425DTXSID50371737

이름 더 보기

2,2-디플루오로벤조디옥솔-5-카르복스알데히드5-FORMYL-2,2-DIFLUOROBENZODIOXOLE2,2-Difluoro-5-formylbenzodioxole 97%2,2-DIFLUORO-5-FORMYL-1,3-BENZODIOXOLE2.2-Difluorobenzodioxole-5-carbaxaldehyde2,2-Difluorobenzodioxole-5-carboxaldehyde98%2,2-Difluorobenzodioxole-5-carboxaldehyde 98%

2,2-difluoro-5-formylbenzodioxolane2,2-DIFLUORO-BENZO[1,3]DIOXOLE-5-CARBALDEHYDEPB17187SY0093822,2-difluorobenzo[1,3]dioxol-5-carbaldehydeEN300-1156171,3-Benzodioxole-5-carboxaldehyde, 2,2-difluoro-1,3-Benzodioxole-5-carboxaldehyde,2,2-difluoro-

데이터베이스 식별자

CAS: 656-42-8
PubChem CID: 2736973
DTXSID: DTXSID50371737
EC Number: 627-939-4
Nikkaji: J2.920.904I

물성

구조 계산 물성

XLogP: 1.8
극성 표면적: 35.5 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 5
회전 가능 결합 수: 1
무거운 원자 수: 13
형식 전하: 0
복잡도: 219

물리화학적 성질

끓는 점: 202 · 202-203 °C(lit.)
밀도: 1.422 g/mL · 1.422 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.5000(lit.)
인화점: 205 °F · 205 °F
저장 조건: Keep in dark place,Sealed in dry,Room Temperature
물리적 상태: 액체
색상: Clear, colourless
수용성: 물에 거의 녹지 않습니다(25°C에서 0.31g/L).
BRN: 1369253 · 1369253
InChI: 1S/C8H4F2O3/c9-8(10)12-6-2-1-5(4-11)3-7(6)13-8/h1-4H
InChIKey: GGERGLKEDUUSAP-UHFFFAOYSA-N
SMILES: [H]C(=O)c1ccc2OC(F)(F)Oc2c1

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

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

Aggregated GHS information provided per 44 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.