(4-Methoxyphenyl)(4-methylphenyl)methanone

HCID 32113CAS 23886-71-7

기본 정보

표준 SMILES: COc1ccc(C(=O)c2ccc(C)cc2)cc1
InChIKey: IHMWJDNMIIEDDN-UHFFFAOYSA-N
분자식: C15H14O2
평균 분자량: 226.27 g/mol
단동위원소 질량: 226.09937969

이름 및 식별자

우선 이름: (4-Methoxyphenyl)(4-methylphenyl)methanone
IUPAC: (4-methoxyphenyl)-(4-methylphenyl)methanone
영어명: 4-Methoxy-4'-methylbenzophenone
분자식: C15H14O2
분자량: 226.27

이름 및 동의어

(4-methoxyphenyl)(4-methylphenyl)methanoneRefChem:402952839-795-123886-71-74-Methoxy-4'-methylbenzophenone(4-Methoxyphenyl)(p-tolyl)methanone(4-methoxyphenyl)-(4-methylphenyl)methanoneMFCD00025812BENZOPHENONE, 4-METHOXY-4'-METHYL-(4-Methoxy-phenyl)-p-tolyl-methanoneNSC 1633574-(4-Methylbenzoyl)anisole

이름 더 보기

4-METHOXY-4'-METHYLBENMETHANONE,(4-METHOXYPHENYL)Methanone, (4-methoxyphenyl)(4-methylphenyl)-(4-Methoxyphenyl)(p-tolyl)methanone, 4-(4-Methylbenzoyl)anisole

BRN 2049977NSC163357SCHEMBL7585774-methyl-4'methoxybenzophenoneRARECHEM AM UC 05214-methyl-4'-methoxybenzophenoneDTXSID50178586HMS1607H06

데이터베이스 식별자

CAS: 23886-71-7
PubChem CID: 32113
DTXSID: DTXSID50178586
EC Number: 839-795-1
Nikkaji: J39.689C

물성

구조 계산 물성

XLogP: 4
극성 표면적: 26.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 3
무거운 원자 수: 17
형식 전하: 0
복잡도: 246

물리화학적 성질

녹는점: 92 °C · 92 °C
끓는 점: 374.9 · 374.9±25.0 °C(Predicted)
밀도: 1.088 · 1.088±0.06 g/cm3(Predicted)
저장 조건: 2 · 2-8°C

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

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

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, 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

HS 번호: 2914500090

화학 및 산업

제조 방법

Also obtained by reaction of p-toluoyl chloride with anisole in the presence of MoO2 Cl2 (20 mol%)in refluxing bromobenzene for 20 h (82%)in refluxing acetonitrile for 20 h (59%)in refluxing methylene chloride for 20 h (49%).