2-(5-메틸-2-푸릴)에탄아민

2-(5-Methylfuran-2-yl)ethan-1-amine

HCID 14933778CAS 30796-85-1

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: Cc1ccc(CCN)o1
InChIKey: KOFWQYALAZVVGL-UHFFFAOYSA-N
분자식: C7H11NO
평균 분자량: 125.17 g/mol
단동위원소 질량: 125.08406397

이름 및 식별자

우선 이름: 2-(5-Methylfuran-2-yl)ethan-1-amine
IUPAC: 2-(5-methylfuran-2-yl)ethanamine
현지명: 2-(5-메틸-2-푸릴)에탄아민
영어명: 2-(5-methyl-2-furyl)ethanamine
분자식: C7H11NO
분자량: 125.17

이름 및 동의어

30796-85-12-(5-Methylfuran-2-yl)ethan-1-amine5-Methyl-2-furanethanamineDTXSID20565686RefChem:458955DTXCID30516462803-413-12-(5-methyl-2-furyl)ethanamine2-(5-Methylfuran-2-yl)ethanamineMFCD080597672-Furanethanamine, 5-methyl-5-Methyl-2-furanethanamine; 2-(5-Methylfuran-2-yl)ethan-1-amine; 2-(5-Methylfuran-2-yl)ethanamine; 2-(5-Methylfuran-2-yl)ethylamine; beta-(5-Methyl-2-furanyl)ethanamine;

이름 더 보기

2-(5-메틸-2-푸릴)에탄아민AKOS ISYA011612-(5-methyl-2-furyl)ethanamine(SALTDATA: FREE)

2-methyl-5-aminoethylfuranSCHEMBL1868584KOFWQYALAZVVGL-UHFFFAOYSA-N2-(5-Methylfuran-2-yl)ethylamineFBA79685beta-(5-methyl-2-furanyl)ethanamine2-(5-Methyl-furan-2-yl)-ethylamineAKOS000154866

데이터베이스 식별자

CAS: 30796-85-1
PubChem CID: 14933778
DTXSID: DTXSID20565686
EC Number: 803-413-1

물성

구조 계산 물성

XLogP: 0.7
극성 표면적: 39.2 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 2
무거운 원자 수: 9
형식 전하: 0
복잡도: 85

물리화학적 성질

저장 조건: Refrigerator, Under inert atmosphere
용해도: 클로로포름(소량으로 용해), 메탄올(약간 용해됨)
물리적 상태: 기름
색상: 밝은 노란색에서 노란색까지

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (95%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (95%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (95%)；Eye Irrit. 2 (95%)；STOT SE 3 (100%)

안전 데이터

HS 번호: 2932190090

화학 및 산업

응용 분야

용도2-(5-Methyl-2-furyl)ethanamine can be used as diarylurea-based cannabinoid 1 receptor (CB1R) allosteric modulators with improved potencies and pharmacokinetic properties.