기본 정보
- CAS
67905-19-5- 표준 SMILES
O=C(O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F- InChIKey
OJMBMWRMTMHMSZ-UHFFFAOYSA-N- 분자식
- C15F31COOH
- 평균 분자량
- 814.13 g/mol
- 단동위원소 질량
- 813.9481523
이름 및 식별자
- 우선 이름
- Perfluorohexadecanoic acid
- IUPAC
- 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,16-hentriacontafluorohexadecanoic acid
- 현지명
- 과불화헥사데칸산
- 영어명
- Perfluorohexadecanoic acid
- 분자식
- C16HF31O2
- 분자량
- 814.13
이름 및 동의어
Perfluorohexadecanoic acid67905-19-5Perfluoropalmitic acid2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,16-hentriacontafluorohexadecanoic acidDTXSID1070800PFHxDA perfluorohexadecanoic acidHexadecanoic acid, 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,16-hentriacontafluoro-RefChem:171660267-638-1hentriacontafluorohexadecanoic acidHexadecanoic acid, hentriacontafluoro-PFHxDA
이름 더 보기
과불화헥사데칸산Perfluorohexadecanoicacid,95%Perfluorohexadecanoic acid 95%hentriacontafluoro-hexadecanoicaciPerfluorohexadecanoic acid in methanolPerfluorohexadecanoi?c Acid DISCONTINUEDPerfluoro-n-hexadecanoic acid in Methanol
perfluorohexadecanoatePerfluoro-n-hexadecanoic acidPerfluorohexadecanoic acid (PFHxDA)MFCD00153239Perfluorohexadecanoic acid 50 microg/mL in Methanol:WaterPerfluoropalmitic acid, Hentriacontafluorohexadecanoic acidC16HF31O2PERFLUOROHEXADECANOICACID
물성
구조 계산 물성
- XLogP
- 10.3
- 극성 표면적
- 37.3 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 33
- 회전 가능 결합 수
- 14
- 무거운 원자 수
- 49
- 형식 전하
- 0
- 복잡도
- 1,250
실험 및 물리화학적 성질
PFAS
PFAS -> Perfluorocarboxylic acids
PFAS -> Identified in migrating and extractable food contact chemical data
PFAS -> PFcarboxylic acids (PFCA)
PFAS -> Other/unspecified
PFAS -> non-polymer
PFAS -> Other/unspecified
Collision Cross Section
226.1 Ų [M-H]- [CCS Type: DT; Buffer gas: N2; Ionization: ESI-; Dataset: PFAS]
227.34 Ų [M-H]-
물리화학적 성질
- 녹는점
- 154 °C · 154 °C
- 끓는 점
- 211 °C · 211 °C
- 밀도
- 1.781 · 1.781±0.06 g/cm3(Predicted)
- 인화점
- 211 °C/100mm · 211°C/100mm
- 산도 계수 (pKa)
- 0.52 · 0.52±0.10(Predicted)
- 물리적 상태
- 고체
- 색상
- 하얀색
- BRN
- 1811511 · 1811511
- EPA
- Perfluoropalmitic acid (67905-19-5)
화학적 성질
White to tan powder
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
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 6 reports by companies from 2 notifications to the ECHA C&L Inventory.
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 CategoriesSkin Corr. 1B (100%)
안전 데이터
- tsca
- TSCA listed
- ridadr
- 3261
- HS 번호
- 29159000
- risk_code
- 34-36/37/38
- hazard_code
- C
- safety_code
- 26-36/37/39-45
- 포장분류
- III
- 위험 등급
- 8
- 위험 참고 사항
- Corrosive
화학 및 산업
용도 및 제조
Uses
• Detected in ski wax [Ref: Plassmann2013]
non-polymer PFAS -> Sports articles -> Ski wax
Use Classification
PFAS -> PFcarboxylic acids (PFCA)
PFAS (per- and polyfluoroalkyl substances) -> OECD Category
General Manufacturing InformationHexadecanoic acid, 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,16-hentriacontafluoro-: ACTIVE
공급사34 곳
艾吉析科技（上海）有限公司17717235263 · [email protected]
广州佳途科技股份有限公司81960175-877 18933936954 · [email protected]
Shandong Hemao New Materials Co., Ltd+86-13061243681 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
湖南嘉航医药科技有限公司85521272 18229978283 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
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