Methoxymethyl-triphenylphosphonium chloride

HCID 2723798

노트 반응

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기본 정보

CAS: 4009-98-7
표준 SMILES: COC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Cl-]
InChIKey: SJFNDMHZXCUXSA-UHFFFAOYSA-M
분자식: C20H20ClOP
평균 분자량: 342.8 g/mol
단동위원소 질량: 342.09402957

이름 및 식별자

우선 이름: Methoxymethyl-triphenylphosphonium chloride
IUPAC: methoxymethyl(triphenyl)phosphanium chloride
영어명: (Methoxymethyl)triphenylphosphonium chloride
분자식: C20H20ClOP
분자량: 342.8

이름 및 동의어

methoxymethyl-triphenylphosphonium chlorideRefChem:811819C20H20ClOP(methoxymethyl)triphenylphosphanium chloridemethoxymethyl(triphenyl)phosphanium;chlorideTriphenyl(methoxymethyl)phosphonium chloride[(Methoxy)methyl]triphenylphosphonium ChlorideMFCD00011800(Methoxymethyl)triphenylphosphoniumchloride(Methoxymethyl) triphenylphosphonium chloride(methoxy methyl)triphenyl phosphonium chloride(methoxymethyl) triphenyl phosphonium chloride

이름 더 보기

MMCMTPPCDOMIT-012AURORA KA-1153(MethoxymethyLphosphonium chLMethoxymethyl tripheMETHOXYMETHYL-TRIPHENYLPHOSPHONIUM-Triphenyl(methoxymethyl)phosphoniummethoxymethyl(triphenyl)phosphanium

(methoxymethyl) (triphenyl)phosphonium chloridemethoxymethyl triphenylphosphonium chloride(MetMethoxymethyltriphenylphosphonium chlorideMethoxymethyl-triphenyl-phosphonium chloride(methoxymethyl)-triphenylphosphonium chlorideFT-0651742SCHEMBL5283

데이터베이스 식별자

CAS: 4009-98-7
PubChem CID: 2723798
DTXSID: DTXSID00960539

물성

구조 계산 물성

극성 표면적: 9.2 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 5
무거운 원자 수: 23
형식 전하: 0
복잡도: 266

물리화학적 성질

녹는점: 185 · 185-195 °C (dec.)(lit.)
증기압: 1 hPa · <1 hPa ( 20 °C)
인화점: 250 °C · >250°C
저장 조건: 30 °C · Store below +30°C.
용해도: 1100 g/l · >1100g/l 용해성,(분해)
물리적 상태: 결정성 분말
색상: 흰색에서 거의 흰색
수소이온지수(pH): 2.2 · 2.2 (1100g/l, H2O, 20℃)
수용성: 물에서 분해되다
BRN: 924215 · 924215
InChI: 1S/C20H20OP.ClH/c1-21-17-22(18-11-5-2-6-12-18,19-13-7-3-8-14-19)20-15-9-4-10-16-20;/h2-16H,17H2,1H3;1H/q+1;/p-1
InChIKey: SJFNDMHZXCUXSA-UHFFFAOYSA-M
SMILES: [Cl-].COC[P+](c1ccccc1)(c2ccccc2)c3ccccc3
LogP: -1.17 · -1.17

화학적 성질

WHITE TO ALMOST WHITE FINE CRYSTALLINE POWDER

안전 및 규제

유해성 정보

Regulatory InformationMethoxymethyl-triphenylphosphonium chloride: Does not have an individual approval but may be used under an appropriate group standard

안전 데이터

wgk: 3
ridadr: UN 1390 4.3/PG 2
HS 번호: 29310095
risk_code: 22-36/37/38
hazard_code: Xn,Xi
safety_code: 26-36-24/25
F 고인화성물질: 3-10
위험 참고 사항: Harmful
Hazard Classifications: Acute Tox. 4 OralAquatic Chronic 2Eye Irrit. 2Skin Irrit. 2
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

응용 분야 · 1건

용도(Methoxymethyl)triphenylphosphonium chloride is used as a phase transfer catalyst and in the synthesis of taxol-A fragment. It is widely used in the synthesis of pharmaceutical product cephalotaxine, which is used as an antiviral and antitumor agent.