기본 정보
- 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)F.[NH4+]- InChIKey
YOALFLHFSFEMLP-UHFFFAOYSA-N- 분자식
- C8HF15O2.H3N
- 평균 분자량
- 431.1 g/mol
- 단동위원소 질량
- 431.00025167
이름 및 식별자
- 우선 이름
- Ammonium perfluorooctanoate
- IUPAC
- azanium 2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctanoate
이름 및 동의어
Ammonium perfluorooctanoate3825-26-1Ammonium pentadecafluorooctanoateAmmonium perfluorocaprylateFluorad FC 143Ammonium perfluorocaprilatePerfluoroammonium octanoateOctanoic acid, pentadecafluoro-, ammonium saltFC-143DTXSID8037708Perfluorooctanoic acid, ammonium saltE904OF18PS
이름 더 보기
DTXCID6017708CXR-1002NSC-35120Octanoic acid, 2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluoro-, ammonium salt (1:1)APFORefChem:112194DTXSID601344239223-320-4
데이터베이스 식별자
- CAS
3825-26-1- PubChem CID
- 2776282
- DTXSID
DTXSID8037708- UNII
- E904OF18PS
- EC Number
- 223-320-4
물성
구조 계산 물성
- 극성 표면적
- 41.1 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 17
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 26
- 형식 전하
- 0
- 복잡도
- 525
실험 및 물리화학적 성질
Chemical ClassesOther Classes -> Perfluoroalkyl Acids
PFAS
PFAS -> Intentionally added food contact chemicals
PFAS -> Other/unspecified
PFAS -> Perfluoroalkyl acids (PFAAs)
PFAS -> Other/unspecified
Endocrine DisruptorsPotential endocrine disrupting compound
Vapor Pressure0.00007 [mmHg]
Physical DescriptionWhite powder; [ACGIH]
안전 및 규제
GHS 분류
GHS Classification
Danger
H302: Harmful if swallowed [Warning Acute toxicity, oral]
P203, P260, P261, P263, P264, P264+P265, P270, P271, P280, P301+P317, P304+P340, P305+P354+P338, P317, P318, P319, P330, P405, and P501 (click each P-code to see the statement)
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P203, P260, P261, P263, P264, P264+P265, P270, P271, P280, P301+P317, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P318, P319, P321, P330, P337+P317, P403+P233, P405, and P501 (click each P-code to see the statement)
유해성 정보
Regulatory Information
Chemical: Octanoic acid, pentadecafluoro-, ammonium salt
Hazard Traits - Bioaccumulation; Environmental Persistence; Reproductive Toxicity
Regulation (EC) No 1935/2004 (amended)
S - indicates a substance that is identified in a final Significant New Use Rule.
Substance: Ammonium pentadecafluorooctanoate (APFO)
Substance: Ammonium pentadecafluorooctanoate
Other Safety InformationIMAP assessments - Perfluorooctanoic acid (PFOA) and its direct precursors: Environment tier II assessment
Hazards Summary
Acute pulmonary edema is observed in animals exposed to lethal concentrations. [ChemIDplus] Confirmed animal carcinogen; Increased blood organofluoride levels in rats receiving repeated doses percutaneously; Workers found to have higher organofluoride levels that controls in plant with air concentrations of 0.032-7.6 mg/m3; Causes liver damage in subchronic animal studies; [ACGIH] See Perfluorooctanoic acid. See Perfluorooctane sulfonic acid.
Hazard Classes and Categories
Acute Tox. 4 (100%)
Acute toxicity - category 3
Acute toxicity (Oral) - Category 4
Reproductive toxicity - Category 1A, Additional category: Effects on or via lactation
Carcinogenicity - Category 2
Carc. 2
안전 및 보호
Threshold Limit Values (TLV)0.01 [mg/m3]
독성 정보
Adverse EffectsOccupational hepatotoxin - Secondary hepatotoxins: the potential for toxic effect in the occupational setting is based on cases of poisoning by human ingestion or animal experimentation.
Toxicity DataLC50 (rat) = 980 mg/m3/4H
RAIS Toxicity Values
3e-08
DWSHA
3e-08
DWSHA
29300
DWSHA
Hazard Quotient Level 0.1 or Cancer Risk Level 1E-06
1.9e-05
7.8e-05
2.7e-06
1.00e+00
4e-08
2.93e+04
Hazard Quotient Level 3 or Cancer Risk Level 1E-04
1.90e-03
7.80e-03
2.70e-04
1.00e+00
2.93e+04
3e-08
화학 및 산업
약리 정보
Biological Half-LifeOrganofluoride compounds: 1-2 years; [ACGIH]
용도 및 제조
Uses
Used to polymerize fluorinated monomers; [ACGIH]
• PFA processing aid [Ref: https://doi.org/10.1016/j.envint.2013.08.021]
General Manufacturing InformationOctanoic acid, 2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluoro-, ammonium salt (1:1): ACTIVE
관련 반응
4건
연결된 노트
불러오는 중…