Thallium(III) trifluoroacetate

HCID 90200

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 23586-53-0
표준 SMILES: O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.[Tl+3]
InChIKey: PSHNNUKOUQCMSG-UHFFFAOYSA-K
분자식: C6F9O6Tl
평균 분자량: 543.43 g/mol

이름 및 식별자

우선 이름: Thallium(III) trifluoroacetate
IUPAC: thallium(3+);tris(2,2,2-trifluoroacetate)
영어명: Thallium(III) trifluoroacetate
분자식: C2H2F3O2Tl
분자량: 319.41

이름 및 동의어

Thallium(III) trifluoroacetate23586-53-0Thallium trifluoroacetateRefChem:189096DTXCID7036901245-761-1DTXSID90669122,2,2-Trifluoroacetic acid, thallium(3+) salt (3:1)Trifluoroacetic acid thallium(III) saltAcetic acid, 2,2,2-trifluoro-, thallium(3+) salt (3:1)Thallic trifluoroacetatethallium(III)trifluoroacetate

이름 더 보기

TTFA(TFA)3TLTHALLIC TRIFLUOROACETATE, TECHTRIFLUOROACETIC ACID THALLICSALTThallium(III)trifluoroacetate97%Thallium(III)trifluoroacetate 95%

EINECS 245-761-1C6F9O6TlTris(trifluoroacetato)thalliumSCHEMBL247993thallium tris(trifluoroacetate)Acetic acid,2,2,2-trifluoro-, thallium(3+) salt (3:1)AKOS015852671thallium(3+);2,2,2-trifluoroacetate

데이터베이스 식별자

CAS: 23586-53-0
PubChem CID: 90200
EC Number: 245-761-1
Nikkaji: J303D

물성

구조 계산 물성

극성 표면적: 120 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 15
회전 가능 결합 수: 0
무거운 원자 수: 22
형식 전하: 0
복잡도: 77.9

실험 및 물리화학적 성질

Chemical ClassesMetals -> Organic Acids, Metal Salts

Physical DescriptionSolid hygroscopic mass; Decomposed by water; [Alfa Aesar MSDS]

물리화학적 성질

녹는점: 213 °C · 213 °C (dec.) (lit.)
저장 조건: 2 · 2-8°C
물리적 상태: 고운 가루
색상: 약간 베이지색~베이지색
수용성: 물에 용해됩니다(분해됨).
InChI: 1S/3C2HF3O2.Tl/c3*3-2(4,5)1(6)7;/h3*(H,6,7);/q;;;+3/p-3
InChIKey: PSHNNUKOUQCMSG-UHFFFAOYSA-K
SMILES: FC(F)(F)C(=O)O[Tl](OC(=O)C(F)(F)F)OC(=O)C(F)(F)F
EPA: Acetic acid, trifluoro-, thallium(3+) salt (23586-53-0)

화학적 성질

slightly beige to beige fine powder

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H300 (100%): Fatal if swallowed [Danger Acute toxicity, oral]

P260, P264, P270, P271, P273, P284, P301+P316, P304+P340, P316, P319, P320, P321, P330, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 45 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazards SummaryAn irritant; Highly toxic by ingestion and inhalation; [Alfa Aesar MSDS] See Sodium fluoroacetate. See Thallium and the linked occupational disease.

Hazard Classes and CategoriesAcute Tox. 2 (100%)

안전 및 보호

Threshold Limit Values (TLV)0.02 [ppm], as Tl (inhalable fraction)

Permissible Exposure Limit (PEL)0.1 [ppm], as Tl

Immediately Dangerous to Life or Health (IDLH)15.0 [ppm], as Tl (soluble compounds)

독성 정보

Adverse EffectsNeurotoxin - Sensorimotor

안전 데이터

wgk: 3
tsca: TSCA listed
ridadr: UN 1707 6.1/PG 2
HS 번호: 29152900
risk_code: 26/28-33-51/53
hazard_code: T+,N,T
safety_code: 13-28-45-61
포장분류: II
위험 등급: 6.1
F 고인화성물질: 3-10-23
위험 참고 사항: Toxic
Hazard Classifications: Acute Tox. 2 InhalationAcute Tox. 2 OralAquatic Chronic 2STOT RE 2
스토리지 클래스: 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials

화학 및 산업

용도 및 제조

General Manufacturing InformationAcetic acid, 2,2,2-trifluoro-, thallium(3+) salt (3:1): INACTIVE

응용 분야

용도Thallium(III) trifluoroacetate is an oxidizing agent used in the synthesis of S-substituted cysteine peptides and proteins containing disulfide bonds.