Pentafluorophenyl diphenylphosphinate

HCID 4652311

노트 반응

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기본 정보

CAS: 138687-69-1
표준 SMILES: O=P(Oc1c(F)c(F)c(F)c(F)c1F)(c1ccccc1)c1ccccc1
InChIKey: OOWSDKUFKGVADH-UHFFFAOYSA-N
분자식: C18H10F5O2P
평균 분자량: 384.2 g/mol
단동위원소 질량: 384.03385729

이름 및 식별자

우선 이름: Pentafluorophenyl diphenylphosphinate
IUPAC: 1-diphenylphosphoryloxy-2,3,4,5,6-pentafluorobenzene
영어명: PENTAFLUOROPHENYL DIPHENYLPHOSPHINATE
분자식: C18H10F5O2P
분자량: 384.24

이름 및 동의어

Pentafluorophenyl diphenylphosphinate138687-69-1DTXSID70405265RefChem:368001DTXCID40356119873-948-3perfluorophenyl diphenylphosphinate1-diphenylphosphoryloxy-2,3,4,5,6-pentafluorobenzeneMFCD00192380FDPPPhosphinic acid, P,P-diphenyl-, 2,3,4,5,6-pentafluorophenyl ester1-diphenylphosphoryloxy-2,3,4,5,6-pentafluoro-benzene

이름 더 보기

Pentafluorophenyl diphenyl phosphateDiphenyl phosphate of pentfluorophenylperfluorophenyl diphenylphosphinate(FDPP)Diphenylphosphinic acid pentafluorophenyl esterPENTAFLUOROPHENYL DIPHENYLPHOSPHINATE Diphenylphosphinic acid pentafluorophenyl ester

Phosphinic acid, diphenyl-, pentafluorophenyl esterC18H10F5O2PSCHEMBL863602perfluorophenyldiphenylphosphinateOOWSDKUFKGVADH-UHFFFAOYSA-NAKOS015900973CS-W009742AS-10634

데이터베이스 식별자

CAS: 138687-69-1
PubChem CID: 4652311
DTXSID: DTXSID70405265
EC Number: 873-948-3
Nikkaji: J724.117H

물성

구조 계산 물성

XLogP: 4.9
극성 표면적: 26.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 7
회전 가능 결합 수: 4
무거운 원자 수: 26
형식 전하: 0
복잡도: 472

물리화학적 성질

녹는점: 47 · 47-50 °C (lit.)
끓는 점: 413.1 · 413.1±55.0 °C(Predicted)
밀도: 1.45 · 1.45
저장 조건: Sealed in dry,Room Temperature
물리적 상태: solid
InChI: InChI=1S/C18H10F5O2P/c19-13-14(20)16(22)18(17(23)15(13)21)25-26(24,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H
InChIKey: OOWSDKUFKGVADH-UHFFFAOYSA-N
SMILES: P(C1=CC=CC=C1)(C1=CC=CC=C1)(OC1=C(F)C(F)=C(F)C(F)=C1F)=O

화학적 성질

White to yellow solid

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (100%)

안전 데이터

wgk: 3
ridadr: UN2811
HS 번호: 29319090
safety_code: 24/25
위험 등급: 6.1
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

응용 분야 · 2건

용도Pentafluorophenyl Diphenylphosphinate is a reagent used as carboxyl activating group and a coupling agent in variety of amide bond formations.

일반 설명Pentafluorophenyl diphenylphosphinate (FDPP) is a reagent, used as a coupling agent in the amide bond forming reactions without racemization. It can also be employed in the synthesis of dipeptides with high yields and good optical purity. FDPP can be prepared from diphenylphosphinic chloride and pentafluorophenol in the presence of imidazole.