4-클로로-3,4'-디메톡시벤조페논

(4-Chlorophenyl)(3,4-dimethoxyphenyl)methanone

HCID 798751

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 116412-83-0
표준 SMILES: COc1ccc(C(=O)c2ccc(Cl)cc2)cc1OC
InChIKey: MLLIIHAKTPXMFF-UHFFFAOYSA-N
분자식: C15H13ClO3
평균 분자량: 276.71 g/mol
단동위원소 질량: 276.05532196

이름 및 식별자

우선 이름: (4-Chlorophenyl)(3,4-dimethoxyphenyl)methanone
IUPAC: (4-chlorophenyl)-(3,4-dimethoxyphenyl)methanone
현지명: 4-클로로-3,4'-디메톡시벤조페논
영어명: 4-Chloro-3,4'-DimethoxyBenzophenone
분자식: C15H13ClO3
분자량: 276.71

이름 및 동의어

116412-83-0(4-Chlorophenyl)(3,4-dimethoxyphenyl)methanone4-Chloro-3',4'-dimethoxybenzophenoneDTXSID60355386EC 404-610-1RefChem:402668DTXCID30306446404-610-1(4-chlorophenyl)-(3,4-dimethoxyphenyl)methanoneMFCD021273074'-Chloro-3,4-dimethoxybenzophenoneMethanone, (4-chlorophenyl)(3,4-dimethoxyphenyl)-

이름 더 보기

4-클로로-3,4'-디메톡시벤조페논4-Chloro-3,4'-DimethoxyBenzophenone4’-chloro-3,4-dimethoxydibenzenemethylone4-CHLORO-(3,4-DIMETHOXY)-BENZOPHENONE 98+%(4-chloro-3-methoxyphenyl)-(4-methoxyphenyl)methanone(4-chlorophenyl)(3,4-dimethoxyphenyl)methanone - [AC77618]

Methanone,(4-chlorophenyl)(3,4-dimethoxyphenyl)-4-chloro-3',4'-dimethoxy benzophenoneCambridge id 6869048Oprea1_261096SCHEMBL6839373CHEMBL1169997SCHEMBL29772213AKOS004909488

데이터베이스 식별자

CAS: 116412-83-0
PubChem CID: 798751
DTXSID: DTXSID60355386
ChEMBL: CHEMBL1169997
EC Number: 404-610-1
Nikkaji: J1.053.258B

물성

구조 계산 물성

XLogP: 4.1
극성 표면적: 35.5 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 4
무거운 원자 수: 19
형식 전하: 0
복잡도: 300

물리화학적 성질

녹는점: 111 · 111-112 °C(Solv: ethanol (64-17-5))
끓는 점: 414.5 · 414.5±45.0 °C(Predicted)
밀도: 1.216 · 1.216±0.06 g/cm3(Predicted)
저장 조건: 2 · 2-8°C
용해도: 에 용해됨클로로포름,디클로로메탄, DMSO, 에틸아세테이트,메탄올
물리적 상태: 고체
색상: 옅은 녹색

안전 및 규제

GHS 분류

GHS Classification · 6건

Warning

H400: Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]

P273, P391, and P501 (click each P-code to see the statement)

Warning

H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]

P273, P391, and P501 (click each P-code to see the statement)

유해성 정보

Regulatory InformationStatus: No longer Valid Update: 10-11-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/8433

Hazard Classes and Categories · 3건

Aquatic Acute 1 (100%)

Hazardous to the aquatic environment (acute) - category 1

Aquatic Acute 1

안전 데이터

risk_code: 50/53
hazard_code: N
safety_code: 60-61

화학 및 산업

응용 분야

용도4-Chloro-3'',4''-dimethoxybenzophenone is an intermedioate in the synthesis of Dimethomorph-d8 (D460532), a labelled agricultural fungicide.

공급사55 곳

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

上海腾准生物科技有限公司19821570922 · [email protected]

上海仲因实业有限公司2537653158 16621191650 · [email protected]

Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

上海辅欣医药科技有限公司+86-021-021-50872116 · [email protected]

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