3-(디플루오로메톡시)벤즈알데히드

3-(Difluoromethoxy)benzaldehyde

HCID 2736985CAS 85684-61-3

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: O=Cc1cccc(OC(F)F)c1
InChIKey: HFIUSWPRDIPIPN-UHFFFAOYSA-N
분자식: C8H6F2O2
평균 분자량: 172.13 g/mol
단동위원소 질량: 172.03358575

이름 및 식별자

우선 이름: 3-(Difluoromethoxy)benzaldehyde
IUPAC: 3-(difluoromethoxy)benzaldehyde
현지명: 3-(디플루오로메톡시)벤즈알데히드
영어명: 3-(Difluoromethoxy)benzaldehyde
분자식: C8H6F2O2
분자량: 172.13

이름 및 동의어

3-(Difluoromethoxy)benzaldehyde85684-61-3DTXSID80371745RefChem:275396DTXCID40322778640-222-0MFCD00236222Benzaldehyde, 3-(difluoromethoxy)-3-difluoromethoxybenzaldehyde3-difluoromethoxy-benzaldehydeSCHEMBL856123BBL011793

이름 더 보기

3-(디플루오로메톡시)벤즈알데히드Benzaldehyde,3-(difluoroMethoxy)-3-(Difluoromethoxy)benzaldehyde98%1-(Difluoromethoxy)-3-formylbenzene3-(Difluoromethoxy)benzaldehyde 98%

CK2107AKOS000103757PS-8669SB85440SY062608AMY2983SCHEMBL29391855SBB064711

데이터베이스 식별자

CAS: 85684-61-3
PubChem CID: 2736985
DTXSID: DTXSID80371745
EC Number: 640-222-0

물성

구조 계산 물성

XLogP: 2.8
극성 표면적: 26.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 4
회전 가능 결합 수: 3
무거운 원자 수: 12
형식 전하: 0
복잡도: 150

물리화학적 성질

끓는 점: 80 · 80-90°C/0.3mm
밀도: 1.3 · 1.300
굴절률: 20 · n20/D 1.496(lit.)
인화점: 107 °C · 107 °C
저장 조건: -20 °C · Inert atmosphere,Store in freezer, under -20°C
물리적 상태: 액체
색상: 무색~연황색

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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 7 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.