메틸피리다진

3-Methylpyridazine

HCID 74208

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 1632-76-4
표준 SMILES: Cc1cccnn1
InChIKey: MXDRPNGTQDRKQM-UHFFFAOYSA-N
분자식: C5H6N2
평균 분자량: 94.11 g/mol
단동위원소 질량: 94.05309819

개요

structure given in first source

이름 및 식별자

우선 이름: 3-Methylpyridazine
IUPAC: 3-methylpyridazine
현지명: 메틸피리다진
영어명: 3-METHYLPYRIDAZINE
분자식: C5H6N2
분자량: 94.11

이름 및 동의어

3-Methylpyridazine1632-76-48PXS99XG8PNSC-96966DTXSID80167529RefChem:94957DTXCID7090020216-640-0PYRIDAZINE, 3-METHYL-MFCD00006469methyldiazine3-methyl pyridazine

이름 더 보기

메틸피리다진3-메틸피리다진SKL0343-Methylpyridazin3-Methyl-1,2-diazinePyridazine,3-methyl-3-Methylpyridazine>3-Methylpyridazine,99%3-Methylpyridazine, 98%3-Methylpyridazine, 99% 5GR

AKOS015902330SY031534M0872EN300-83809Pyridazine, methyl-Z12456483243-Methyl-1,2-diazine; NSC 96966LCZC2189

데이터베이스 식별자

CAS: 1632-76-4
PubChem CID: 74208
DTXSID: DTXSID80167529
UNII: 8PXS99XG8P
EC Number: 216-640-0
Nikkaji: J149.936J

물성

구조 계산 물성

XLogP: -0.3
극성 표면적: 25.8 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 0
무거운 원자 수: 7
형식 전하: 0
복잡도: 54

실험 및 물리화학적 성질

SpringerMaterials Properties15N nuclear magnetic resonance spectrum

LogP-0.35

물리화학적 성질

녹는점: 184 °C · 184°C
끓는 점: 214 °C · 214 °C (lit.)
밀도: 1.031 g/mL · 1.031 g/mL at 25 °C (lit.)
굴절률: 20 · n20/D 1.514(lit.)
인화점: 190 °F · 190 °F
저장 조건: Inert atmosphere,Room Temperature
용해도: 에 용해됨클로로포름, 메탄올 (약간 용해됨)
산도 계수 (pKa): 3.47 · 3.47±0.10(Predicted)
물리적 상태: 액체
색상: 투명한 노란색에서 갈색까지
Specific Gravity: 1.031 · 1.031
BRN: 105691 · 105691
InChI: 1S/C5H6N2/c1-5-3-2-4-6-7-5/h2-4H,1H3
InChIKey: MXDRPNGTQDRKQM-UHFFFAOYSA-N
SMILES: Cc1cccnn1

화학적 성질

CLEAR YELLOW TO BROWN 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 110 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

안전 데이터

wgk: 3
HS 번호: 29339980
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36/37/39
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스: 10 - Combustible liquids

화학 및 산업

응용 분야 · 2건

용도3-Methylpyridazine can be used to diagnose and treat cardiovascular diseases and conditions.

일반 설명3-Methylpyridazine(3-Mepydz) reacts with halogenotrimethylplatinum (IV), [PtXMe3)4], to form complexes of type fac-[PtXMe3(3-Mepydz)2] (X = Cl, Br or I). It undergoes self-association in aqueous solution at acidic, neutral and basic pH . It is a diazaaromatic compound and reacts with bis (1,1,1,5,5,5-hexafluoropentane-2,4-dionato) copper (II) complexes.