2-Iodo-6-methylpyridin-3-ol

HCID 89957CAS 23003-30-7

기본 정보

표준 SMILES: Cc1ccc(O)c(I)n1
InChIKey: HRZOWBGCOJWHDY-UHFFFAOYSA-N
분자식: C6H6INO
평균 분자량: 235.02 g/mol
단동위원소 질량: 234.94941181

이름 및 식별자

우선 이름: 2-Iodo-6-methylpyridin-3-ol
IUPAC: 2-iodo-6-methylpyridin-3-ol
영어명: 3-Hydroxy-2-iodo-6-methylpyridine
분자식: C6H6INO
분자량: 235.02

이름 및 동의어

23003-30-72-Iodo-6-methylpyridin-3-ol2-Iodo-6-methyl-3-pyridinolEINECS 245-376-9HRZOWBGCOJWHDY-UHFFFAOYSA-DTXSID20177561RefChem:473720DTXCID80100052245-376-9InChI=1/C6H6INO/c1-4-2-3-5(9)6(7)8-4/h2-3,9H,1H33-Hydroxy-2-iodo-6-methylpyridine3-Pyridinol, 2-iodo-6-methyl-

이름 더 보기

3-Hydroxy-2-iodo-6-6-Iodo-2-picolin-5-ol,97%6-IODO-2-PICOLIN-5-OL 97%2-IODO-3-HYDROXY-6-PICOLINE2-IODO-6-METHYL-3-HYDROXYPYRIDINE

2-Iodo-6-methyl-pyridin-3-olMFCD000062466-Iodo-2-picolin-5-ol2-Iodo-6-picolin-3-ol6-iodo-2-picoline-5-ol2-Iodo-6-methyl-3-pyridinol #2-iodo-3-hydroxy-6-methylpyridine3-Hydroxy-2-iodo-6-picoline

데이터베이스 식별자

CAS: 23003-30-7
PubChem CID: 89957
DTXSID: DTXSID20177561
EC Number: 245-376-9
Nikkaji: J236.698C

물성

구조 계산 물성

XLogP: 1.6
극성 표면적: 33.1 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 0
무거운 원자 수: 9
형식 전하: 0
복잡도: 99.1

물리화학적 성질

녹는점: 197 · 197-199 °C (lit.)
끓는 점: 292 · 292.0±35.0 °C(Predicted)
밀도: 1.8615 · 1.8615 (estimate)
저장 조건: Keep in dark place,Sealed in dry,Room Temperature
산도 계수 (pKa): 5.46 · 5.46±0.10(Predicted)
InChI: InChI=1S/C6H6INO/c1-4-2-3-5(9)6(7)8-4/h2-3,9H,1H3
InChIKey: HRZOWBGCOJWHDY-UHFFFAOYSA-N
SMILES: C1(I)=NC(C)=CC=C1O

화학적 성질

Light yellow to yellow 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 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.