에틸3-하이드록시페닐아세테이트

Ethyl (3-Hydroxyphenyl)acetate

HCID 572437CAS 22446-38-4

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CCOC(=O)Cc1cccc(O)c1
InChIKey: NSQBADKMIYCCSC-UHFFFAOYSA-N
분자식: C10H12O3
평균 분자량: 180.2 g/mol
단동위원소 질량: 180.07864424

이름 및 식별자

우선 이름: Ethyl (3-Hydroxyphenyl)acetate
IUPAC: ethyl 2-(3-hydroxyphenyl)acetate
현지명: 에틸3-하이드록시페닐아세테이트
영어명: ethyl 3-hydroxyphenylacetate
분자식: C10H12O3
분자량: 180.2

이름 및 동의어

Ethyl (3-hydroxyphenyl)acetateRefChem:593081834-774-3ethyl 2-(3-hydroxyphenyl)acetate22446-38-4ETHYL 3-HYDROXYPHENYLACETATEMFCD07369387(3-Hydroxyphenyl)acetic Acid Ethyl EsterBenzeneacetic acid, 3-hydroxy-, ethyl ester3-Hydroxyphenylacetic acid ethyl esterethyl 3-hydoxyphenylacetateethyl(3-hydroxyphenyl)acetate

이름 더 보기

에틸3-하이드록시페닐아세테이트3-Hydroxy-benzeneacetic Acid Ethyl EsterBenzeneaceticacid, 3-hydroxy-, ethyl ester

Acetic acid, (m-hydroxyphenyl)-, ethyl esterDS-8512CS-0030409E1242SCHEMBL905142ethyl2-(3-hydroxyphenyl)acetateDTXSID20341346Ethyl (3-hydroxyphenyl)acetate #

데이터베이스 식별자

CAS: 22446-38-4
PubChem CID: 572437
DTXSID: DTXSID20341346
EC Number: 834-774-3
Nikkaji: J101.860D

물성

구조 계산 물성

XLogP: 1.5
극성 표면적: 46.5 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 3
회전 가능 결합 수: 4
무거운 원자 수: 13
형식 전하: 0
복잡도: 168

물리화학적 성질

끓는 점: 179 °C/12mmHg · 179°C/12mmHg(lit.)
밀도: 1.146 · 1.146±0.06 g/cm3(Predicted)
굴절률: 1.522 to · 1.5220 to 1.5270
저장 조건: Inert atmosphere,Room Temperature
용해도: soluble in Dichloromethane, Ethyl Acetate, Toluene
산도 계수 (pKa): 9.75 · 9.75±0.10(Predicted)
물리적 상태: 투명한 액체
색상: Light yellow to Yellow to Orange
안정성: 냉동고에 보관

화학적 성질

Light Yellow Liquid

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.