기본 정보
- CAS
3020-28-8- 표준 SMILES
IC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[I-]- InChIKey
NAVMMSRRNOXQMJ-UHFFFAOYSA-M- 분자식
- C19H17I2P
- 평균 분자량
- 530.1 g/mol
- 단동위원소 질량
- 529.91573317
이름 및 식별자
- 우선 이름
- (Iodomethyl)triphenylphosphonium iodide
- IUPAC
- iodomethyl(triphenyl)phosphanium iodide
- 현지명
- 요오드메틸-트리페닐-포스포늄요오드화물
- 영어명
- IODOMETHYL-TRIPHENYL-PHOSPHONIUM IODIDE
- 분자식
- C19H17IP.I
- 분자량
- 530.12
이름 및 동의어
(Iodomethyl)triphenylphosphonium iodideRefChem:406544663-309-53020-28-8Iodomethyl-triphenyl-phosphonium iodideMFCD09025335C19H17I2Piodomethyl(triphenyl)phosphanium;iodideIodomethyl triphenylphosphonium iodidePhosphonium, (iodomethyl)triphenyl-, iodideiodomethyl(triphenyl)phosphonium;iodideSCHEMBL291942
이름 더 보기
요오드메틸-트리페닐-포스포늄요오드화물IodomethyLNSC 116665-triphenyL-phosphonium iodideiodomethyl-triphenyl-phosphaniumiodo-(iodomethyl)-triphenylphosphoraneiodomethyl(triphenyl)phosphanium,iodide(Iodomethyl)triphenylphosphonium iodide 95%Iodomethyl triphenylphosphonium iodide 95 %(iodomethyl)triphenyl-Phosphonium iodide (1:1)
DTXSID30450291NAVMMSRRNOXQMJ-UHFFFAOYSA-M(Iodomethyl)triphenylphosphoniumIodideIodomethyl-triphenylphosphonium iodideNSC116665AKOS015917430iodomethyl(triphenyl)phosphonium iodideNSC-116665
데이터베이스 식별자
- CAS
3020-28-8- PubChem CID
- 10973449
- DTXSID
DTXSID30450291- EC Number
- 663-309-5
물성
구조 계산 물성
- 극성 표면적
- 0 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 22
- 형식 전하
- 0
- 복잡도
- 253
물리화학적 성질
- 녹는점
- 260 · 260-266°C
- 저장 조건
- 2 · under inert gas (nitrogen or Argon) at 2–8 °C
- 물리적 상태
- solid
- InChI
- InChI=1S/C19H17IP.HI/c20-16-21(17-10-4-1-5-11-17,18-12-6-2-7-13-18)19-14-8-3-9-15-19;/h1-15H,16H2;1H/q+1;/p-1
- InChIKey
- NAVMMSRRNOXQMJ-UHFFFAOYSA-M
- SMILES
- [P+](CI)(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.[I-]
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
안전 데이터
- wgk
- WGK 3
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-28
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
응용 분야
용도Reactant or reagent for synthesis of: Phosphacyclic compounds via oxidative dimerizationsEnamides via cross-couplingCyclopeptide alkaloids for use as antibacterial or cytotoxic agentsTerminal alkynes via dehydrohalogenation of aldehydesReactant for vinylcyclopropanation / cyclopentenation of strained alkenes using a sequential carborhodation processUsed as an olefination agent in the Lewis acid catalysis of electrocyclization of trienes
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