2,2,2-트리플루오로에틸트리클로로메탄설포네이트

2,2,2-Trifluoroethyl trichloromethanesulphonate

HCID 90027CAS 23199-56-6

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: O=S(=O)(OCC(F)(F)F)C(Cl)(Cl)Cl
InChIKey: GOIWZZQXWJVDOG-UHFFFAOYSA-N
분자식: C3H2Cl3F3O3S
평균 분자량: 281.5 g/mol
단동위원소 질량: 279.87423262

이름 및 식별자

우선 이름: 2,2,2-Trifluoroethyl trichloromethanesulphonate
IUPAC: 2,2,2-trifluoroethyl trichloromethanesulfonate
현지명: 2,2,2-트리플루오로에틸트리클로로메탄설포네이트
영어명: 2,2,2-TRIFLUOROETHYL TRICHLOROMETHANESULFONATE
분자식: C3H2Cl3F3O3S
분자량: 281.47

이름 및 동의어

23199-56-62,2,2-Trifluoroethyl trichloromethanesulphonateEINECS 245-484-6Methanesulfonic acid, 1,1,1-trichloro-, 2,2,2-trifluoroethyl esterDTXSID70177778Methanesulfonic acid, trichloro-, 2,2,2-trifluoroethyl esterRefChem:440555DTXCID30100269245-484-62,2,2-trifluoroethyl trichloromethanesulfonateMFCD000424002,2,2-trifluoroethyltrichloromethanesulfonate

이름 더 보기

2,2,2-트리플루오로에틸트리클로로메탄설포네이트LABOTEST-BB LT004556562,2,2-trifluoroethyl trichloromethylsulfonate2,2,2-Trifluoroethyl trichlorometanesulphonate2,2,2-Trifluoroethyltrichloromethanesulphonate97%2,2,2-Trifluoroethyl trichloromethanesulphonate 97%trichloromethanesulfonic acid 2,2,2-trifluoroethyl esterTrichloromethanesulphonic acid 2,2,2-trifluoroethyl ester

C3H2Cl3F3O3S2,2,2-trifluoroethyl (trichloromethyl)sulfonateSCHEMBL55106SBB058039trifluoroethyl trichloromethylsulfonateAKOS015848706trifluoroethyl trichloromethanesulphonateAS-10559

데이터베이스 식별자

CAS: 23199-56-6
PubChem CID: 90027
DTXSID: DTXSID70177778
EC Number: 245-484-6
Nikkaji: J318.423D

물성

구조 계산 물성

XLogP: 2.7
극성 표면적: 51.8 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 6
회전 가능 결합 수: 2
무거운 원자 수: 13
형식 전하: 0
복잡도: 260

물리화학적 성질

녹는점: -70 °C · -70°C
끓는 점: 84 · 84-86°C 20mm
밀도: 1 · 1,714 g/cm3
굴절률: 1.4238 · 1.4238
인화점: 84 · 84-86°C/20mm
물리적 상태: 액체
BRN: 1108366 · 1108366

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H301+H311+H331 (20%): Toxic if swallowed, in contact with skin or if inhaled [Danger Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]

P203, P260, P261, P262, P264, P270, P271, P280, P301+P316, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P318, P321, P330, P361+P364, P363, 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.