4-메틸-5-이미다졸메탄올염산염

4-Methylimidazol-5-ylmethanolhydrochloride

HCID 3084707CAS 38585-62-5

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: Cc1[nH]cnc1CO.Cl
InChIKey: UBHDUFNPQJWPRQ-UHFFFAOYSA-N
분자식: C5H9ClN2O
평균 분자량: 148.59 g/mol
단동위원소 질량: 148.04034059

이름 및 식별자

우선 이름: 4-Methylimidazol-5-ylmethanolhydrochloride
IUPAC: (5-methyl-1H-imidazol-4-yl)methanol;hydrochloride
현지명: 4-메틸-5-이미다졸메탄올염산염
영어명: 4-Methyl-5-imidazolemethanol hydrochloride
분자식: C5H9ClN2O
분자량: 148.59

이름 및 동의어

38585-62-54-Methylimidazol-5-ylmethanolhydrochlorideEINECS 254-021-7DTXSID40191906RefChem:99893DTXCID40114397254-021-7(4-methyl-1H-imidazol-5-yl)methanol hydrochloride4-Methyl-5-imidazolemethanol hydrochloride4-Hydroxymethyl-5-methylimidazole Hydrochloride(5-methyl-1H-imidazol-4-yl)methanol hydrochlorideMFCD00040986

이름 더 보기

4-메틸-5-이미다졸메탄올염산염5(4)-METHYL-4(5)-IMIDAZOLE METHANOL4-Methyl-5-HydroxymethylimidazoleHCl4-Hydroxymethyl-5-methylimidazole HCl5-METHYL-4-HYDROXYMETHYL IMIDAZOLE HCLCimetidine Impurity I as Hydrochloride4-Methyl-5-imidazolemethanol Hydrochlori4-Methyl-5-imidazolemethanolhydrochilride4-Methyl-5-imidazolemethanol hydrochlirde

4-Methyl-5-imidazolemethanol HCl4-methyl-5-hydroxymethylimidazole hydrochloride5-Hydroxymethyl-4-methylimidazole hydrochloride4-Methyl-(5-hydroxymethyl)imidazole hydrochloride5-Hydroxymethyl-4-methylimidazole HCl(5-methyl-1H-imidazol-4-yl)methanol;hydrochloride4-Methyl-5-hydroxymethylimidazole, HClAKOS005216608

데이터베이스 식별자

CAS: 38585-62-5
PubChem CID: 3084707
DTXSID: DTXSID40191906
EC Number: 254-021-7

물성

구조 계산 물성

극성 표면적: 48.9 Å²
수소 결합 공여자 수: 3
수소 결합 수용자 수: 2
회전 가능 결합 수: 1
무거운 원자 수: 9
형식 전하: 0
복잡도: 76.8

실험 및 물리화학적 성질

Chemical ClassesNitrogen Compounds -> Imidazoles

Physical DescriptionBeige granules; [Sigma-Aldrich MSDS]

물리화학적 성질

녹는점: 233 °C · 233 °C (dec.)(lit.)
저장 조건: Inert atmosphere,Room Temperature
용해도: DMSO(적게), 메탄올(약간)에 용해됨
물리적 상태: 결정성 분말
색상: 약간 베이지색
InChI: 1S/C5H8N2O.ClH/c1-4-5(2-8)7-3-6-4;/h3,8H,2H2,1H3,(H,6,7);1H
InChIKey: UBHDUFNPQJWPRQ-UHFFFAOYSA-N
SMILES: Cl.Cc1[nH]cnc1CO

화학적 성질

VERY SLIGHTLY BEIGE CRYSTALLINE POWDER

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 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazards SummaryAn irritant; [Synthonix MSDS] See 2-Methylimidazole.

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

안전 데이터

wgk: 3
HS 번호: 29332900
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-37/39
기존화학 물질: KE-24301
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

응용 분야

용도4-Methyl-5-imidazolemethanol hydrochloride was used in the synthesis of 1,3-bis(5-methyl-4-imidazolyl)-2-thiapropane (tridentate ligand).

상·하류 제품 정보

상류 원료

공급사50 곳

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Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

上海弘顺生物科技有限公司15901914505 · [email protected]

Syntechem Co.,Ltd[email protected]

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