3-Bromo-1-phenyl-5-(pyridin-2-yl)-1,2-dihydropyridin-2-one

HCID 22319065

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 381248-06-2
표준 SMILES: O=c1c(Br)cc(-c2ccccn2)cn1-c1ccccc1
InChIKey: GSESXDVCGLBTLD-UHFFFAOYSA-N
분자식: C16H11BrN2O
평균 분자량: 327.17 g/mol
단동위원소 질량: 326.00548

이름 및 식별자

우선 이름: 3-Bromo-1-phenyl-5-(pyridin-2-yl)-1,2-dihydropyridin-2-one
IUPAC: 3-bromo-1-phenyl-5-pyridin-2-ylpyridin-2-one
영어명: 5'-broMo-1'-phenyl-[2,3'-bipyridin]-6'(1'H)-one
분자식: C16H11BrN2O
분자량: 327.18

이름 및 동의어

3-bromo-1-phenyl-5-(pyridin-2-yl)-1,2-dihydropyridin-2-oneRefChem:498263800-315-0381248-06-23-bromo-5-(2-pyridyl)-1-phenyl-1,2-dihydropyridin-2-one5'-broMo-1'-phenyl-[2,3'-bipyridin]-6'(1'H)-one3-bromo-1-phenyl-5-pyridin-2-ylpyridin-2-oneMFCD216073923-BROMO-1-PHENYL-5-(PYRIDIN-2-YL)PYRIDIN-2(1H)-ONE[2,3'-Bipyridin]-6'(1'H)-one, 5'-bromo-1'-phenyl-5'-Bromo-1'-phenyl[2,3'-bipyridin]-6'(1'H)-onePyronoprene Impurity 20

이름 더 보기

BL102Perampanel Intermediate 35'-Bromo-1'-phenyl-1'H-[2,3']bipyridinyl-6'-one3-Bromo-1-phenyl-5-(pyridin-2-yl)-2(1H)-pyridone

3-Bromo-1-phenyl-5-(pyridin-2-yl)-2(1H)-pyridone; 5'-Bromo-1'-phenyl-[2,3'-bipyridin]-6'(1'H)-one;AX2T252GNESCHEMBL688116DTXSID90624698GSESXDVCGLBTLD-UHFFFAOYSA-NAKOS016028484CH-0052SY258272

데이터베이스 식별자

CAS: 381248-06-2
PubChem CID: 22319065
DTXSID: DTXSID90624698
UNII: AX2T252GNE
EC Number: 800-315-0
Nikkaji: J2.403.721E

물성

구조 계산 물성

XLogP: 3
극성 표면적: 33.2 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 2
무거운 원자 수: 20
형식 전하: 0
복잡도: 438

물리화학적 성질

녹는점: 79 · 79-81°C
끓는 점: 461.7 · 461.7±45.0 °C(Predicted)
밀도: 1.539 · 1.539±0.06 g/cm3(Predicted)
저장 조건: 2 · 2-8°C
용해도: 클로로포름 (약간 용해됨), DMSO (약간 용해됨)
물리적 상태: 고체
산도 계수 (pKa): 4.73 · 4.73±0.19(Predicted)
색상: 밝은 갈색에서 갈색까지
안정성: 감광성

안전 및 규제

GHS 분류

GHS Classification · 6건

This chemical does not meet GHS hazard criteria for 66.7% (2 of 3) of all reports.

Warning

H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (33.3%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H332 (33.3%): Harmful if inhaled [Warning Acute toxicity, inhalation]

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)

Aggregated GHS information provided per 3 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Reported as not meeting GHS hazard criteria per 2 of 3 reports by companies.；There is 1 notification provided by 1 of 3 reports by companies with hazard statement code(s).；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.