기본 정보
- CAS
376-73-8- 표준 SMILES
O=C(O)C(F)(F)C(F)(F)C(F)(F)C(=O)O- InChIKey
CCUWGJDGLACFQT-UHFFFAOYSA-N- 분자식
- C5H2F6O4
- 평균 분자량
- 240.06 g/mol
- 단동위원소 질량
- 239.98572786
이름 및 식별자
- 우선 이름
- Perfluoroglutaric acid
- IUPAC
- 2,2,3,3,4,4-hexafluoropentanedioic acid
- 현지명
- 육불화글루타르산
- 영어명
- Hexafluoroglutaric acid
- 분자식
- C5H2F6O4
- 분자량
- 240.06
이름 및 동의어
Hexafluoroglutaric acid376-73-8Perfluoroglutaric acidPentanedioic acid, hexafluoro-2,2,3,3,4,4-Hexafluoropentanedioic acidGlutaric acid, hexafluoro-AI43ZAB49WNSC 6826NSC-6826EINECS 206-813-9Pentanedioic acid, 2,2,3,3,4,4-hexafluoro-2,2,3,3,4,4-hexafluoroglutaric acid
이름 더 보기
육불화글루타르산hexafluoroglutaricTIMTEC-BB SBB000791Perfluoroglutaricacid98%Hexafluoroglutaricacid98%HexafluoroglutaricAcid>hexafluoro-pentanedioicaciPerfluoroglutaric acid 98%
Glutaric acid, hexafluoroRefChem:860251Pentanedioic acid, hexafluoroGlutaric acid, hexafluoro (8CI)Glutaric acid, hexafluoro-(8CI)Pentanedioic acid, 2,2,3,3,4,4hexafluoro206-813-9Hexafluoropentanedioic Acid
데이터베이스 식별자
- CAS
376-73-8- PubChem CID
- 67827
- DTXSID
DTXSID8059926- UNII
- AI43ZAB49W
- EC Number
- 206-813-9
- Nikkaji
- J208.602F
물성
구조 계산 물성
- XLogP
- 1.4
- 극성 표면적
- 74.6 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 10
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 15
- 형식 전하
- 0
- 복잡도
- 270
실험 및 물리화학적 성질
Chemical ClassesOther Classes -> Organic Acids
PFAS
PFAS -> OECD Category
PFAS -> Other/unspecified
PFAS -> Other/unspecified
Physical DescriptionBeige highly hygroscopic crystals; [Sigma-Aldrich MSDS]
물리화학적 성질
- 녹는점
- 88 · 88-91 °C (lit.)
- 끓는 점
- 134 · 134-138 °C/3 mmHg (lit.)
- 밀도
- 1.6649 · 1.6649 (estimate)
- 인화점
- 134 · 134-138°C/3mm
- 저장 조건
- 2 · Storage temp. 2-8°C
- 산도 계수 (pKa)
- 0.23 · 0.23±0.10(Predicted)
- 물리적 상태
- powder to crystal
- 색상
- White to Brown to Dark purple
- BRN
- 1801049 · 1801049
- 안정성
- 흡습성
- InChI
- 1S/C5H2F6O4/c6-3(7,1(12)13)5(10,11)4(8,9)2(14)15/h(H,12,13)(H,14,15)
- InChIKey
- CCUWGJDGLACFQT-UHFFFAOYSA-N
- SMILES
- OC(=O)C(F)(F)C(F)(F)C(F)(F)C(O)=O
- EPA
- Pentanedioic acid, hexafluoro- (376-73-8)
화학적 성질
almost white to light beige adhering cryst. powder
안전 및 규제
GHS 분류
GHS Classification
Danger
H314 (97.9%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 47 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Hazards SummaryCauses burns; [Sigma-Aldrich MSDS] See Perfluorobutyric acid.
Hazard Classes and CategoriesSkin Corr. 1B (97.9%)
독성 정보
Adverse EffectsDermatotoxin - Skin burns.
안전 데이터
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 3261 8/PG 3
- HS 번호
- 29171900
- risk_code
- 34-37
- hazard_code
- C,Xi
- safety_code
- 26-36/37/39-45
- 위험 등급
- 8
- F 고인화성물질
- 3
- 위험 참고 사항
- Corrosive/Hygroscopic
- Hazard Classifications
- Eye Dam. 1Skin Corr. 1B
- 스토리지 클래스
- 8A - Combustible corrosive hazardous materials
화학 및 산업
용도 및 제조
Use ClassificationPFAS (per- and polyfluoroalkyl substances) -> OECD Category
General Manufacturing InformationPentanedioic acid, 2,2,3,3,4,4-hexafluoro-: ACTIVE
상·하류 제품 정보
하류 제품
공급사65 곳
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