2,2,2-트리플루오로에틸퍼플루오로부틸술포네이트

2,2,2-Trifluoroethyl perfluorobutylsulfonate

HCID 2777144

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 79963-95-4
표준 SMILES: O=S(=O)(OCC(F)(F)F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIKey: KJGYBFLEIPDFNQ-UHFFFAOYSA-N
분자식: C6H2F12O3S
평균 분자량: 382.13 g/mol
단동위원소 질량: 381.95330356

이름 및 식별자

우선 이름: 2,2,2-Trifluoroethyl perfluorobutylsulfonate
IUPAC: 2,2,2-trifluoroethyl 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate
현지명: 2,2,2-트리플루오로에틸퍼플루오로부틸술포네이트
영어명: 2,2,2-Trifluoroethyl perfluorobutylsulfonate
분자식: C6H2F12O3S
분자량: 382.13

이름 및 동의어

2,2,2-Trifluoroethyl perfluorobutylsulfonateRefChem:440553628-380-979963-95-42,2,2-Trifluoroethyl Nonafluorobutanesulfonate2,2,2-trifluoroethyl 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate2,2,2-Trifluoroethyl PerfluorobutanesulfonateMFCD03093638Nonafluorobutanesulfonic Acid 2,2,2-Trifluoroethyl Ester2,2,2-Trifluoroethyl perfluorobutanesulphonateDTXSID60380390C6H2F12O3S

이름 더 보기

2,2,2-트리플루오로에틸퍼플루오로부틸술포네이트TPS2,2,2,-Trifluoroethyl2,2,2-TRIFLUOROETHYL PERFLUOROBUTYL SULF2,2,2-TRIFLUOROETHYL PERFLUORO BUTYLSULFONATE2,2,2-trifluoroethyl Perfluorobutane Sulfonat2,2,2-trifluoroethyl nonafluorobutyl sulfonate

1,1,2,2,3,3,4,4,4-Nonafluorobutane-1-sulfonic Acid 2,2,2-trifluoroethyl Ester;2,2,2-Trifluoroethyl 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate;2,2,2-Trifluoroethyl Nonafluorobutanesulfonate;SCHEMBL2864392,2,2-trifluoroethylnonaflateAKOS015852770trifluoroethanol perfluorobutanesulphonateSY0504532,2,2-trifluoroethylnonafluorobutanesulfonateCS-0199242

데이터베이스 식별자

CAS: 79963-95-4
PubChem CID: 2777144
DTXSID: DTXSID60380390
EC Number: 628-380-9
Nikkaji: J2.639.519D

물성

구조 계산 물성

XLogP: 4
극성 표면적: 51.8 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 15
회전 가능 결합 수: 5
무거운 원자 수: 22
형식 전하: 0
복잡도: 494

실험 및 물리화학적 성질

PFAS · 3건

PFAS -> Other/unspecified

PFAS -> OECD Category

PFAS -> Other/unspecified

물리화학적 성질

끓는 점: 138 · 138-140
밀도: 1.636 g/mL · 1.636 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.326(lit.)
인화점: 160 °F · 160 °F
저장 조건: Store at room temperature
용해도: DMSO(약간 용해됨), 메탄올(약간 용해됨)
물리적 상태: 투명한 액체
색상: 무색~연황색
안정성: 흡습성, 용액 내 불안정
InChI: 1S/C6H2F12O3S/c7-2(8,9)1-21-22(19,20)6(17,18)4(12,13)3(10,11)5(14,15)16/h1H2
InChIKey: KJGYBFLEIPDFNQ-UHFFFAOYSA-N
SMILES: FC(F)(F)COS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
EPA: 2 · 2,2,2-Trifluoroethyl perfluorobutanesulfonate (79963-95-4)

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.

유해성 정보

Hazard Classes and CategoriesSkin Corr. 1B (100%)

안전 데이터

wgk: 3
ridadr: UN 3265 8/PG 2
HS 번호: 2905599890
risk_code: 34
hazard_code: C,T
safety_code: 26-36/37/39-45
위험 등급: TOXIC, CORROSIVE
위험 참고 사항: Toxic/Corrosive
Hazard Classifications: Skin Corr. 1B
스토리지 클래스: 8A - Combustible corrosive hazardous materials

화학 및 산업

용도 및 제조

Use ClassificationPFAS (per- and polyfluoroalkyl substances) -> OECD Category

응용 분야

용도2,2,2-Trifluoroethyl perfluorobutylsulfonate may be used in the synthesis of 1,2,3,4-tetrahydro-1,1,4,4-tetramethyl-6,7-bis(2,2,2-trifluoro-ethoxy)-naphthalene (TTBN).

상·하류 제품 정보

하류 제품

BIS(2,2,2-TRIFLUOROETHYL)아민

공급사51 곳

陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]

上海钰博生物科技有限公司021-60514606 18321282235 · [email protected]

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

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