2-(5-Methyl-2-phenyl-4-oxazolyl)ethanol

HCID 725585

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 103788-65-4
표준 SMILES: Cc1oc(-c2ccccc2)nc1CCO
InChIKey: JYWHQBLLIBQGCU-UHFFFAOYSA-N
분자식: C12H13NO2
평균 분자량: 203.24 g/mol
단동위원소 질량: 203.09462866

개요

2-(5-Methyl-2-phenyl-1,3-oxazol-4-yl)ethan-1-ol is a member of 1,3-oxazoles.

이름 및 식별자

우선 이름: 2-(5-Methyl-2-phenyl-4-oxazolyl)ethanol
IUPAC: 2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethanol
영어명: 2-(5-Methyl-2-phenyl-1,3-oxazol-4-yl)ethan-1-ol
분자식: C12H13NO2
분자량: 203.24

이름 및 동의어

2-(5-Methyl-2-phenyl-4-oxazolyl)ethanolRefChem:458945103788-65-42-(5-Methyl-2-phenyl-1,3-oxazol-4-yl)ethan-1-ol2-(5-Methyl-2-phenyloxazol-4-yl)ethanol2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethanol2-(5-methyl-2-phenyloxazole-4-yl)ethanol2-(5-methyl-2-phenyl-oxazol-4-yl)-ethanolMFCD001000062-(5-methyl-2-phenyl-oxazol-4-yl)ethanol4-OXAZOLEETHANOL, 5-METHYL-2-PHENYL-4-(2-Hydroxyethyl)-5-methyl-2-phenyloxazol

이름 더 보기

MURA-001BUTTPARK 37\06-812-(5-Methyl-2-phenyl-1,3-...5-Methyl-2-phenyl-oxazoleethanol2-(5-methyl-2-phenyloxazol-4-yl)ethan-1-ol

5-Methyl-2-phenyl-oxazoleethanol; 2-(5-Methyl-2-phenyl-1,3-oxazol-4-yl)ethan-1-ol; 2-(5-Methyl-2-phenyl-1,3-oxazol-4-yl)ethanol; 4-(2-Hydroxyethyl)-5-methyl-2-phenyloxazole;4-(2-hydroxyethyl)-5-methyl-2-phenyl-1,3-oxazoleMaybridge3_000599SCHEMBL979145orb3031052DTXSID00352394CHEBI:194850JYWHQBLLIBQGCU-UHFFFAOYSA-N

데이터베이스 식별자

CAS: 103788-65-4
PubChem CID: 725585
DTXSID: DTXSID00352394
ChEBI: CHEBI:194850
EC Number: 673-134-6
Nikkaji: J1.565.574G

물성

구조 계산 물성

XLogP: 2
극성 표면적: 46.3 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 3
회전 가능 결합 수: 3
무거운 원자 수: 15
형식 전하: 0
복잡도: 192

물리화학적 성질

녹는점: 72 °C · 72 °C
끓는 점: 365.4 · 365.4±34.0 °C(Predicted)
밀도: 1.146 · 1.146±0.06 g/cm3(Predicted)
저장 조건: 2 · 2-8°C
용해도: 클로로포름(약간 용해됨), 메탄올(약간 용해됨)
물리적 상태: 고체
산도 계수 (pKa): 14.36 · 14.36±0.10(Predicted)
색상: 페일베이지

화학적 성질

Pale-Yellow Solid

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)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.