CAS 851341-36-1 1-(Methoxymethoxy)-2-(trifluoromethoxy)benzene (HCID 12179649)

기본 정보

CAS: 851341-36-1
표준 SMILES: COCOc1ccccc1OC(F)(F)F
InChIKey: SUFHTGIPVZIIFB-UHFFFAOYSA-N
분자식: C9H9F3O3
평균 분자량: 222.16 g/mol
단동위원소 질량: 222.05037863

이름 및 식별자

우선 이름: 1-(Methoxymethoxy)-2-(trifluoromethoxy)benzene
IUPAC: 1-(methoxymethoxy)-2-(trifluoromethoxy)benzene
현지명: 1-메톡시메톡시-2-(트리플루오로메톡시)벤젠
영어명: 1-Methoxymethoxy-2-(trifluoromethoxy)benzene
분자식: C9H9F3O3
분자량: 222.16

이름 및 동의어

851341-36-11-(Methoxymethoxy)-2-(trifluoromethoxy)benzeneDTXSID90479342RefChem:226780DTXCID104301521-Methoxymethoxy-2-(trifluoromethoxy)benzeneBenzene,1-(methoxymethoxy)-2-(trifluoromethoxy)-MFCD097434641-methoxymethoxy-2-trifluoromethoxybenzeneSCHEMBL2322334SCHEMBL29860268AKOS016015674

이름 더 보기

1-메톡시메톡시-2-(트리플루오로메톡시)벤젠

DS-020559E90224

데이터베이스 식별자

CAS: 851341-36-1
PubChem CID: 12179649
DTXSID: DTXSID90479342
EC Number: 642-764-3
Nikkaji: J2.158.986A

물성

구조 계산 물성

XLogP: 2.8
극성 표면적: 27.7 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 6
회전 가능 결합 수: 4
무거운 원자 수: 15
형식 전하: 0
복잡도: 184

물리화학적 성질

끓는 점: 51 · 51-52 °C(Press: 6 Torr)
밀도: 1.257 · 1.257±0.06 g/cm3(Predicted)

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 (20%): 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 5 reports by companies from 2 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.