기본 정보
- CAS
2706-91-4- 표준 SMILES
O=S(=O)(O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F- InChIKey
ACEKLXZRZOWKRY-UHFFFAOYSA-N- 분자식
- C5F11SO3H
- 평균 분자량
- 350.11 g/mol
- 단동위원소 질량
- 349.94707485
이름 및 식별자
- 우선 이름
- Perfluoropentanesulfonic acid
- IUPAC
- 1,1,2,2,3,3,4,4,5,5,5-undecafluoropentane-1-sulfonic acid
- 현지명
- 퍼플루오로펜탄-1-술폰산
- 영어명
- perfluoropentane-1-sulphonic acid
- 분자식
- C5HF11O3S
- 분자량
- 350.11
이름 및 동의어
perfluoropentanesulfonic acid2706-91-41-Pentanesulfonic acid, 1,1,2,2,3,3,4,4,5,5,5-undecafluoro-1,1,2,2,3,3,4,4,5,5,5-undecafluoropentane-1-sulfonic acidPerfluoropentane-1-sulfonic acid1,1,2,2,3,3,4,4,5,5,5-Undecafluoro-1-pentanesulfonic acidDTXSID8062600undecafluoro-1-pentanesulfonic AcidYWK28LB8TLPFPeS perfluoropentanesulfonic acidRefChem:860286DTXCID4037613
이름 더 보기
퍼플루오로펜탄-1-술폰산Perfluoropentanesulphonic acidPerfluoropentanesulfonic acid in methanolUndecafluoropentanesulfonic Acid See P698190Perfluoropentanesulfonic acid 100 μg/mL in Methanol:Water
220-301-2PFPeSPerfluoropentane-1-sulphonic acidUNDECAFLUOROPENTANE-1-SULFONIC ACIDPerfluoropentanesulfonic acid hydrate5-DOXYL-stearic Acid, Free Radical (>90%)C5HF11O3SEINECS 220-301-2
데이터베이스 식별자
- CAS
2706-91-4- PubChem CID
- 75922
- DTXSID
DTXSID8062600- UNII
- YWK28LB8TL
- EC Number
- 220-301-2
- Nikkaji
- J192.214I
물성
구조 계산 물성
- XLogP
- 3
- 극성 표면적
- 62.8 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 14
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 20
- 형식 전하
- 0
- 복잡도
- 469
실험 및 물리화학적 성질
Chemical Classes
Ionic Liquids -> Fluorinated Ionic Liquids
Ionic Liquids
PFAS
PFAS -> Perfluorosulfonic acids
PFAS -> PFsulfonic acids (PFSA)
PFAS -> Other/unspecified
PFAS -> non-polymer
PFAS -> Other/unspecified
PFAS -> OECD Category
Collision Cross Section142.2 Ų [M-H]- [CCS Type: DT; Buffer gas: N2; Ionization: ESI-; Dataset: PFAS]
물리화학적 성질
- 녹는점
- 300 °C · >300°C
- 끓는 점
- 225 °C · 225 °C
- 밀도
- 1.844 · 1.844±0.06 g/cm3(Predicted)
- 용해도
- 아세톤(약간 용해됨), DMSO(약간 용해됨), 메탄올(약간 용해됨)
- 물리적 상태
- 고체
- 산도 계수 (pKa)
- -3.56 · -3.56±0.50(Predicted)
- 색상
- 회백색
- InChI
- InChI=1S/C5HF11O3S/c6-1(7,2(8,9)4(12,13)14)3(10,11)5(15,16)20(17,18)19/h(H,17,18,19)
- InChIKey
- ACEKLXZRZOWKRY-UHFFFAOYSA-N
- SMILES
- C(F)(F)(S(O)(=O)=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P330, P363, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Not Classified
유해성 정보
Regulatory Information
Hazard Traits - Hazard Trait Undefined
S - indicates a substance that is identified in a final Significant New Use Rule.
Hazard Classes and CategoriesAcute Tox. 4 (100%)
안전 데이터
- tsca
- TSCA listed
- HS 번호
- 2904990090
화학 및 산업
용도 및 제조
Uses
• AFFF (detected) [Ref: https://doi.org/10.1021/es3034999]
non-polymer PFAS -> Fire-Fighting Foam -> Aqueous film-forming foams (AFFF)
Use Classification
PFAS -> PFsulfonic acids (PFSA)
PFAS (per- and polyfluoroalkyl substances) -> OECD Category
General Manufacturing Information1-Pentanesulfonic acid, 1,1,2,2,3,3,4,4,5,5,5-undecafluoro-: INACTIVE
응용 분야
용도Undecafluoropentanesulfonic Acid is derived from Perfluoroamyl Iodide (P286320), which can be used in the synthesis of perfluoroalkylated olefins and perfluoroalkanoic acids.
공급사10 곳
艾吉析科技（上海）有限公司17717235263 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
西安莱茵生物科技有限公司86-(0)29-85992781 17792393971 · [email protected]
Novachemistry44-20819178-90 02081917890 · [email protected]
上海泰坦科技股份有限公司13023226327 · [email protected]
河南天孚化工有限公司+86-0371-55170693 +86-19937530512 · [email protected]
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