Methyl 5-hydroxypyridine-2-carboxylate

HCID 4715126

노트 반응

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기본 정보

CAS: 30766-12-2
표준 SMILES: COC(=O)c1ccc(O)cn1
InChIKey: YYAYXDDHGPXWTA-UHFFFAOYSA-N
분자식: C7H7NO3
평균 분자량: 153.14 g/mol
단동위원소 질량: 153.04259308

이름 및 식별자

우선 이름: Methyl 5-hydroxypyridine-2-carboxylate
IUPAC: methyl 5-hydroxypyridine-2-carboxylate
영어명: 5-HYDROXY-PYRIDINE-2-CARBOXYLIC ACID METHYL ESTER
분자식: C7H7NO3
분자량: 153.14

이름 및 동의어

30766-12-2methyl 5-hydroxypyridine-2-carboxylateDTXSID80405832RefChem:817113DTXCID90356684857-630-1Methyl 5-hydroxypicolinate5-Hydroxy-pyridine-2-carboxylic acid methyl esterMFCD052564262-PYRIDINECARBOXYLIC ACID, 5-HYDROXY-, METHYL ESTERMETHYL 5-HYDROXY-2-PYRIDINECARBOXYLATESCHEMBL164488

이름 더 보기

H57157Methyl 5-hydroxypyridine-...Methyl 5-hydroxy-2-picolinateMethyl 5-hydroxypyridine-2-ca5-HDROXY-PYRIDINE-2-CARBOXYLIC ACID METHYMethyl 5-hydroxypyridine-2-carboxylate ,97%Methyl 5-hydroxypyridine-2-carboxylate 95+%

5-hydroxypicolinic acid methyl ester5-HYDROXY-2-PYRIDINECARBOXYLIC ACID METHYL ESTERAS-5315EN300-316372methyl 5-hydroxypicolinate;H571575-Hydroxypyridine-2-carboxylic acid methyl esterorb1303263SCHEMBL31463324

데이터베이스 식별자

CAS: 30766-12-2
PubChem CID: 4715126
DTXSID: DTXSID80405832
EC Number: 857-630-1

물성

구조 계산 물성

XLogP: 0
극성 표면적: 59.4 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 4
회전 가능 결합 수: 2
무거운 원자 수: 11
형식 전하: 0
복잡도: 149

물리화학적 성질

녹는점: 193.5 · 193.5-195.5℃
끓는 점: 374.2 · 374.2±22.0 °C(Predicted)
밀도: 1.287 · 1.287±0.06 g/cm3(Predicted)
저장 조건: Inert atmosphere,Room Temperature
물리적 상태: 고체
산도 계수 (pKa): 8.29 · 8.29±0.10(Predicted)
색상: 옅은 노랑

화학적 성질

Yellow solid

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 50% (1 of 2) of reports.

Warning

H315 (50%): 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 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.