CAS 21092-94-4 1-(4-(Benzyloxy)-3-hydroxyphenyl)ethanone (HCID 10681628)

기본 정보

CAS: 21092-94-4
표준 SMILES: CC(=O)c1ccc(OCc2ccccc2)c(O)c1
InChIKey: VZAWEXLHZPLCGE-UHFFFAOYSA-N
분자식: C15H14O3
평균 분자량: 242.27 g/mol
단동위원소 질량: 242.0942943

이름 및 식별자

우선 이름: 1-(4-(Benzyloxy)-3-hydroxyphenyl)ethanone
IUPAC: 1-(3-hydroxy-4-phenylmethoxyphenyl)ethanone
현지명: 에타논,1-[3-하이드록시-4-(페닐메톡시)페닐]-
영어명: Ethanone, 1-[3-hydroxy-4-(phenylMethoxy)phenyl]-
분자식: C15H14O3
분자량: 242.27

이름 및 동의어

1-(4-(Benzyloxy)-3-hydroxyphenyl)ethanone21092-94-44'-benzyloxy-3'-hydroxyacetophenone1-(3-hydroxy-4-phenylmethoxyphenyl)ethanone3'-hydroxy4'-benzyloxyacetophenoneEthanone, 1-[3-hydroxy-4-(phenylmethoxy)phenyl]-1-[4-(benzyloxy)-3-hydroxyphenyl]ethanoneSCHEMBL1545310SCHEMBL29803481DTXSID90443462VZAWEXLHZPLCGE-UHFFFAOYSA-NDB-336728

이름 더 보기

에타논,1-[3-하이드록시-4-(페닐메톡시)페닐]-1-(4-(Benzyloxy)-3-hydroxyphenyl)ethan-1-one1-[3-Hydroxy-4-(phenylmethoxy)phenyl]ethanone

1-[4-(Benzyloxy)-3-hydroxyphenyl]ethan-1-oneC90811

데이터베이스 식별자

CAS: 21092-94-4
PubChem CID: 10681628
DTXSID: DTXSID90443462

물성

구조 계산 물성

XLogP: 2.7
극성 표면적: 46.5 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 3
회전 가능 결합 수: 4
무거운 원자 수: 18
형식 전하: 0
복잡도: 271

물리화학적 성질

녹는점: 118 °C · 118°C

화학 및 산업

제조 방법

Preparation by reaction of benzyl chloride with 3,4-di-hydroxyacetophenone in the presence of potassium hydroxide in a refluxing mixture of ethanol, methanol and water (53%).