메틸2-클로로-6-메톡시피리딘-4-카르복실레이트

Methyl 2-chloro-6-methoxyisonicotinate

HCID 13339618

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 42521-10-8
표준 SMILES: COC(=O)c1cc(Cl)nc(OC)c1
InChIKey: DAPAXVAUEVRBGS-UHFFFAOYSA-N
분자식: C8H8ClNO3
평균 분자량: 201.61 g/mol
단동위원소 질량: 201.0192708

이름 및 식별자

우선 이름: Methyl 2-chloro-6-methoxyisonicotinate
IUPAC: methyl 2-chloro-6-methoxypyridine-4-carboxylate
현지명: 메틸2-클로로-6-메톡시피리딘-4-카르복실레이트
영어명: METHYL 2-CHLORO-6-METHOXYPYRIDINE-4-CARBOXYLATE
분자식: C8H8ClNO3
분자량: 201.61

이름 및 동의어

methyl 2-chloro-6-methoxyisonicotinate42521-10-8methyl 2-chloro-6-methoxypyridine-4-carboxylateMFCD00173929Methyl2-chloro-6-methoxyisonicotinate2-CHLORO-6-METHOXY-ISONICOTINICACIDMETHYLESTERDTXSID00537402AKOS005072979methyl-2-chloro-6-methoxyisonicotinateAB043823-HYDROXY-2-METHOXYFLAVONE2-Chloro-6-methoxy-isonicotinic acid methyl ester

이름 더 보기

메틸2-클로로-6-메톡시피리딘-4-카르복실레이트2-chloro-6-methoxyisoacidmethyl ester2-(2-chloro-6-methoxypyridin-4-yl)acetic acid2-Chloro-6-methoxyisonicotinic acid methyl esterMethyl2-chloro-6-methoxypyridine-4-carboxylate,98%4-Pyridinecarboxylic acid, 2-chloro-6-methoxy-, methyl esterMethyl 2-chloro-6-methoxyisonicotinate 2-Chloro-6-methoxyisonicotinic acid methyl esterMethyl 2-chloro-6-methoxypyridine-4-carboxylate, 2-Chloro-6-methoxy-4-(methoxycarbonyl)pyridine

methyl (2-chloro-6-methoxypyridin-4-yl)carboxylateSCHEMBL567975SCHEMBL6964278SCHEMBL31287794DAPAXVAUEVRBGS-UHFFFAOYSA-NCL0091SBB092816HA-0921

데이터베이스 식별자

CAS: 42521-10-8
PubChem CID: 13339618
DTXSID: DTXSID00537402
EC Number: 670-264-5

물성

구조 계산 물성

XLogP: 2
극성 표면적: 48.4 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 4
회전 가능 결합 수: 3
무거운 원자 수: 13
형식 전하: 0
복잡도: 188

물리화학적 성질

녹는점: 97.5 ° · 97.5°
끓는 점: 281 ℃ · 281℃
밀도: 1.288 · 1.288
인화점: 124 ℃ · 124℃
저장 조건: 2 · Storage temp. 2-8°C
물리적 상태: 가루
산도 계수 (pKa): -0.89 · -0.89±0.10(Predicted)
색상: White fibrous

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 4 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.