4-아세틸비벤질

1-(4-(2-Phenylethyl)phenyl)ethan-1-one

HCID 69918CAS 785-78-4

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CC(=O)c1ccc(CCc2ccccc2)cc1
InChIKey: KIRXEYNVGWVPRO-UHFFFAOYSA-N
분자식: C16H16O
평균 분자량: 224.3 g/mol
단동위원소 질량: 224.12011513

이름 및 식별자

우선 이름: 1-(4-(2-Phenylethyl)phenyl)ethan-1-one
IUPAC: 1-[4-(2-phenylethyl)phenyl]ethanone
현지명: 4-아세틸비벤질
영어명: 4-Acetylbibenzyl
분자식: C16H16O
분자량: 224.3

이름 및 동의어

4-Acetylbibenzyl785-78-41-[4-(2-Phenylethyl)phenyl]ethanone1-[4-(2-phenylethyl)phenyl]ethan-1-one1-(4-(2-Phenylethyl)phenyl)ethan-1-oneCW3P2K55C8Ethanone, 1-[4-(2-phenylethyl)phenyl]-EINECS 212-323-6Ethanone, 1-(4-(2-phenylethyl)phenyl)-DTXSID902291271-(4-(2-PHENYLETHYL)PHENYL)ETHANONERefChem:424308

이름 더 보기

4-아세틸비벤질4-ACETYLBIBENZYL(WXG02447)1-(4-Acetylphenyl)-2-phenylethane1-[4-methyl-3-(2-methylphenyl)phenyl]ethanone

DTXCID10151618212-323-61-(4-phenethylphenyl)ethanone4'-phenethylacetophenone1-(4-Phenethylphenyl)ethan-1-oneMFCD00070637UNII-CW3P2K55C84-acetylbibenzyl, AldrichCPR

데이터베이스 식별자

CAS: 785-78-4
PubChem CID: 69918
DTXSID: DTXSID90229127
UNII: CW3P2K55C8
EC Number: 212-323-6
Nikkaji: J193.177F

물성

구조 계산 물성

XLogP: 3.8
극성 표면적: 17.1 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 4
무거운 원자 수: 17
형식 전하: 0
복잡도: 232

물리화학적 성질

녹는점: 68 °C · 68 °C
물리적 상태: solid
InChI: 1S/C16H16O/c1-13(17)16-11-9-15(10-12-16)8-7-14-5-3-2-4-6-14/h2-6,9-12H,7-8H2,1H3
InChIKey: KIRXEYNVGWVPRO-UHFFFAOYSA-N
SMILES: CC(=O)c1ccc(CCc2ccccc2)cc1

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationChemical: Ethanone, 1-[4-(2-phenylethyl)phenyl]-

Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

안전 데이터

wgk: WGK 3
HS 번호: 2912290090
위험 등급: IRRITANT
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

공급사14 곳

陕西凯尔凯医药科技有限公司029-2148545164 17392779578 · [email protected]

杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]

Aladdin Scientific[email protected]

上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]

武汉凯威斯科技有限公司86-027-67849912 · [email protected]

연결된 노트

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