Methyl 2,2,3,3,4,4,4-heptafluorobutanoate

METHYL PERFLUOROBUTYRATE · Methyl perfluorobutanoate · METHYL HEPTAFLUOROBUTYRATE · methylheptafluorobutanoate · METHYL PERFLUORO-N-BUTYRATE · Methyl heptafluorobutanoate · MethylHeptafluorobutyrate>METHYL HEPTAFLUORO-N-BUTYRATE · Methyl perfluorobutanoate 98%

https://huagongshe.com/ko/chemical/67741

Methyl 2,2,3,3,4,4,4-heptafluorobutanoate 분자 구조식

식별자 및 물리적 특성

CAS No.	356-24-1
분자식	C5H3F7O2
평균 분자량	228.06 g/mol
단동위원소 질량	228.00212688 g/mol
SMILES	COC(=O)C(F)(F)C(F)(F)C(F)(F)F
InChIKey	MRPUVAKBXDBGJQ-UHFFFAOYSA-N
PubChem CID	67741
EC No.	206-600-0
DTXSID	DTXSID4059881

화학 및 물리적 성질

XLogP	2.6
극성 표면적	26.3
수소 결합 공여자 수	0
수소 결합 수용자 수	9
회전 가능 결합 수	3
무거운 원자 수	14
형식 전하	0
복잡도	231
PFAS	PFAS -> Other/unspecifiedPFAS -> PFAS identified in REACH Regulation EC No. 1272/2008PFAS -> OECD Category
SpringerMaterials Properties	Diamagnetic susceptibility
녹는점	-86°C
끓는 점	80-81 °C(lit.)
밀도	1.472 g/mL at 25 °C(lit.)
증기 밀도	>1 (vs air)
굴절률	n20/D 1.293(lit.)
인화점	>230 °F
저장 조건	Storage temp. 2-8°C
용해도	물에 약간 용해됨
물리적 상태	투명한 액체
비중	1.472
색상	무색 내지 거의 무색
BRN	1792131
InChI	InChI=1S/C5H3F7O2/c1-14-2(13)3(6,7)4(8,9)5(10,11)12/h1H3
InChIKey	MRPUVAKBXDBGJQ-UHFFFAOYSA-N
SMILES	C(OC)(=O)C(F)(F)C(F)(F)C(F)(F)F
EPA	Methyl heptafluorobutyrate (356-24-1)

화학적 성질

clear colorless liquid

안전 및 규제

GHS 분류	WarningH315 (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 45 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
규제 정보	Status: Active Update: 15-12-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/24059
Hazard Classes and Categories	Skin Irrit. 2 (100%)
수질 위해 등급(WGK)	3
TSCA 등재 상태	TSCA listed
운송 번호(UN)	UN 3272 3/PG II
관세 코드	29159000
위험 문구(R)	36/37/38
위험 표시	Xi,F
안전 문구(S)	26-36-36/37/39
포장분류	II
위험 등급	IRRITANT, FLAMMABLE
위험 참고 사항	Flammable

용도

Methyl Heptafluorobutyrate is used in method for preparing high-carbon branched secondary Alcohol, and its application in preparing surfactant.