CAS 52411-35-5 5-Ethyl-2-hydroxybenzaldehyde (HCID 6429811)

기본 정보

CAS: 52411-35-5
표준 SMILES: CCc1ccc(O)c(C=O)c1
InChIKey: XSTCLZHMZASDDK-UHFFFAOYSA-N
분자식: C9H10O2
평균 분자량: 150.17 g/mol
단동위원소 질량: 150.06807956

이름 및 식별자

우선 이름: 5-Ethyl-2-hydroxybenzaldehyde
IUPAC: 5-ethyl-2-hydroxybenzaldehyde
현지명: 5-에틸-2-하이드록시-벤잘데하이드
영어명: 5-Ethyl-2-hydroxy-benzaldehyde
분자식: C9H10O2
분자량: 150.17

이름 및 동의어

5-ethyl-2-hydroxybenzaldehyde52411-35-5DTXSID20423939RefChem:102547DTXCID40374777864-821-35-ethyl-2-hydroxybenzenecarbaldehyde5-Ethyl-2-hydroxy-benzaldehydeMFCD067395145-ethyl-salicylaldehydeSCHEMBL305074Benzaldehyde, 2-hydroxy, 5-ethyl

이름 더 보기

5-에틸-2-하이드록시-벤잘데하이드Benzaldehyde, 5-ethyl-2-hydroxy-5ethyl-2-hydroxybenzenemethylaldehyde4-Ethyl-2-formylphenol, 5-Ethylsalicylaldehyde

CS-0196267E900145-AethylsalicylaldehydFT-0600731SCHEMBL3450955SCHEMBL3450956CHEMBL22892295-Ethyl-2-hydroxy-phenyl-methanone

데이터베이스 식별자

CAS: 52411-35-5
PubChem CID: 6429811
DTXSID: DTXSID20423939
ChEMBL: CHEMBL2289229
EC Number: 864-821-3
Nikkaji: J2.724.761J

물성

구조 계산 물성

XLogP: 2.4
극성 표면적: 37.3 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 2
무거운 원자 수: 11
형식 전하: 0
복잡도: 134

물리화학적 성질

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, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.