(1R,2R)-2-(3,4-디플루오로페닐)시클로프로판카르복실산

(1R,2R)-2-(3,4-Difluorophenyl)cyclopropanecarboxylic acid

HCID 9834218CAS 1006614-50-1

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기본 정보

표준 SMILES: O=C(O)[C@@H]1C[C@H]1c1ccc(F)c(F)c1
InChIKey: CSLVZAGSOJLXCT-NKWVEPMBSA-N
분자식: C10H8F2O2
평균 분자량: 198.168 g/mol
단동위원소 질량: 198.04923594

이름 및 식별자

우선 이름: (1R,2R)-2-(3,4-Difluorophenyl)cyclopropanecarboxylic acid
IUPAC: (1R,2R)-2-(3,4-Difluorophenyl)cyclopropane-1-carboxylic acid
현지명: (1R,2R)-2-(3,4-디플루오로페닐)시클로프로판카르복실산
영어명: (1R,2R)-2-(3,4-difluorophenyl)cyclopropanecarboxylic acid
분자식: C10H8F2O2
분자량: 198.17

이름 및 동의어

(1R,2R)-2-(3,4-디플루오로페닐)시클로프로판카르복실산(1R,2R)-2-(3,4-difluorophenyl)cyclopropane-1-carboxylic acidTicagrelor-22Ticagerelor ImpurityTicagrelor Related Compound 28(1R,2R)-2-(3,4-difluorophenyl)cyclopropanecarboxylic acid(1R,2R)-2-(3,4-difluorophenyl)cyclopropane-1-carboxylicaciCyclopropanecarboxylic acid, 2-(3,4-difluorophenyl)-, (1R,2R)-(1R-2R)-2-(3,4-DIFLUOROPHENYL)CYCLOPROPANECARBOXYLIC ACID CAS 220352-36-3Ticagrelor impurity 33/(1R,2R)-2-(3,4-Difluorophenyl)cyclopropanecarboxylic acid(1R,2R)-2-(3,4-diFluorophenyl)cyclopropanecarboxylic acid (ticagrelor intermediate)

데이터베이스 식별자

CAS: 1006614-50-1、220352-36-3
PubChem CID: 9834218
DTXSID: DTXSID60431457
EC Number: 188-019-1
Nikkaji: J2.688.118H

물성

물리화학적 성질

녹는점: 78 · 78 - 81°C
끓는 점: 308.1 · 308.1±42.0 °C(Predicted)
밀도: 1.435 · 1.435±0.06 g/cm3(Predicted)
저장 조건: Sealed in dry,Room Temperature
용해도: 클로로포름(약간 용해됨), DMSO(약간 용해됨), 메탄올(약간 용해됨)
산도 계수 (pKa): 4.53 · 4.53±0.10(Predicted)
물리적 상태: 고체
색상: 회백색

안전 및 규제

안전 데이터

HS 번호: 2916200090

화학 및 산업

응용 분야 · 1건

용도(1R,2R)-2-(3,4-Difluorophenyl)-cyclopropanecarboxylic Acid is an intermediate used to prepare AZD6140 as an orally active reversible P2Y12 receptor antagonist for prevention of thrombosis. It is also used to synthesize triazolopyrimidine derivatives as P2T receptor antagonists.