옥타플루오로이소부틸에테르메틸

1,1,1,3,3-Pentafluoro-3-methoxy-2-(trifluoromethyl)propane

HCID 45459CAS 382-26-3

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: COC(F)(F)C(C(F)(F)F)C(F)(F)F
InChIKey: AQHKYFLVHBIQMS-UHFFFAOYSA-N
분자식: C5H4F8O
평균 분자량: 232.07 g/mol
단동위원소 질량: 232.01344051

이름 및 식별자

우선 이름: 1,1,1,3,3-Pentafluoro-3-methoxy-2-(trifluoromethyl)propane
IUPAC: 2-[difluoro(methoxy)methyl]-1,1,1,3,3,3-hexafluoropropane
현지명: 옥타플루오로이소부틸에테르메틸
영어명: Octafluoroisobutyl ether methyl
분자식: C5H4F8O
분자량: 0

이름 및 동의어

2-[difluoro(methoxy)methyl]-1,1,1,3,3,3-hexafluoropropane1,1,1,3,3-pentafluoro-3-methoxy-2-(trifluoromethyl)propane2-(Difluoro(methoxy)methyl)-1,1,1,3,3,3-hexafluoropropaneDTXSID40880146EC 609-534-4RefChem:409405DTXCID50136202609-534-4382-26-363919-03-91,1,3,3,3-Pentafluoro-2-trifluoromethylpropyl methyl etherMethyl 1,1,3,3,3-pentafluoro-2-(trifluoromethyl)propyl ether

이름 더 보기

옥타플루오로이소부틸에테르메틸OCTAFLUOROISOBUTYLMETHYLETHEROctafluoroisobutyl ether methyl

1,1,1,3,3-Pentafluoro-2-(trifluoromethyl)-4-oxapentaneMFCD00054689Octafluoroisobutyl methyl etherPropane, 2-(difluoromethoxymethyl)-1,1,1,3,3,3-hexafluoro-Methyl 1,1,3,3,3-pentafluoro-2-(trifluoromethyl)-propyl etherETHER, METHYL OCTAFLUOROISOBUTYL(CF3)2CHCF2OCH3SCHEMBL1199052

데이터베이스 식별자

CAS: 382-26-3、63919-03-9
PubChem CID: 45459
DTXSID: DTXSID40880146
EC Number: 609-534-4
Nikkaji: J27.131D

물성

구조 계산 물성

XLogP: 3.3
극성 표면적: 9.2 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 9
회전 가능 결합 수: 2
무거운 원자 수: 14
형식 전하: 0
복잡도: 177

실험 및 물리화학적 성질

PFAS · 5건

PFAS -> Other/unspecified

PFAS -> PFAS identified in REACH Regulation EC No. 1272/2008

PFAS -> Other/unspecified

PFAS -> OECD Category

PFAS -> Suspected persistent, mobile, toxic (PMT) PFAS or PFAS-like compounds

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H225 (33.3%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P203, P210, P233, P240, P241, P242, P243, P260, P261, P262, P264, P270, P271, P272, P280, P284, P301+P316, P302+P352, P303+P361+P353, P304+P340, P316, P318, P320, P321, P330, P333+P317, P361+P364, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.