2-Carbomethoxypyridine (HCID 75569)

개요

Methyl picolinate is a member of pyridines and an aromatic carboxylic acid.

이름 및 식별자

우선 이름: 2-Carbomethoxypyridine
IUPAC: methyl pyridine-2-carboxylate
영어명: Methyl picolinate
분자식: C7H7NO2
분자량: 137.14

이름 및 동의어

Methyl picolinate2459-07-6Methyl pyridine-2-carboxylate2-Pyridinecarboxylic acid, methyl ester2-Picolinic acid methyl esterMethyl 2-pyridinecarboxylatePicolinic acid, methyl ester2-CarbomethoxypyridineII4AAE7Y3A2-(Methoxycarbonyl)pyridineNSC-1459DTXSID4062432

이름 더 보기

Methyl-2-PicolinateMethyl picoliteTIMTEC-BB SBB008127RARECHEM AL BF 0182Pyridine-2-carboxyLpicolin methyl esterPICOLINIC ACID METHYL ESTER

NSC 1459EINECS 219-545-2RefChem:468174DTXCID0037102Picolinic acid, methyl ester (8CI)Methyl pyridine-2-carboxylate; 2-CarbomethoxypyridinePyridine-2-carboxylic acid methyl estermethylpicolinate

데이터베이스 식별자

CAS: 2459-07-6
PubChem CID: 75569
DTXSID: DTXSID4062432
ChEMBL: CHEMBL309354
ChEBI: CHEBI:167765
UNII: II4AAE7Y3A
EC Number: 219-545-2
Nikkaji: J27.977C

물성

구조 계산 물성

XLogP: 0.4
극성 표면적: 39.2 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 2
무거운 원자 수: 10
형식 전하: 0
복잡도: 125

실험 및 물리화학적 성질

SpringerMaterials PropertiesSchoenflies notation

LogP0.4

물리화학적 성질

녹는점: 19 ℃ · 19℃
끓는 점: 95 °C1 · 95 °C1 mm Hg(lit.)
밀도: 1.137 g/mL · 1.137 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.521(lit.)
인화점: 217 °F · 217 °F
저장 조건: Inert atmosphere,Room Temperature
물리적 상태: 결정성 분말
산도 계수 (pKa): 1 · pK1:2.21(+1) (25°C)
색상: 하얀색
수용성: 물에 약간 용해됩니다.
InChI: 1S/C7H7NO2/c1-10-7(9)6-4-2-3-5-8-6/h2-5H,1H3
InChIKey: NMMIHXMBOZYNET-UHFFFAOYSA-N
SMILES: COC(=O)c1ccccn1
NIST: 2 · 2-Pyridinecarboxylic acid, methyl ester(2459-07-6)
EPA: 2 · 2-Pyridinecarboxylic acid, methyl ester (2459-07-6)

화학적 성질

Colorless to yellow 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 42 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationChemical: 2-Pyridinecarboxylic acid, methyl ester

Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

안전 데이터

wgk: 3
tsca: TSCA listed
HS 번호: 29333990
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스: 10 - Combustible liquids

화학 및 산업

용도 및 제조

General Manufacturing Information2-Pyridinecarboxylic acid, methyl ester: INACTIVE

응용 분야

용도Methyl picolinate is used as pharmaceutical intermediate.

일반 설명Methyl picolinate (MP) exists in two conformers i.e s-trans and s-cis. Molecular structure of these forms has been investigated by gas electron diffraction.

상·하류 제품 정보

상류 원료

2-피리딘카르복사미드,N,N-디메틸-(9CI)Methyl picolinimidate 2-(Trimethylsilyl)pyridine 2-Iodopyridine 2-피리딘카르복실산,메틸에스테르,1-옥사이드(9CI)피콜린산 메틸알콜

하류 제품

6-히드록시피리딘-2-카르복시산 1,3-DI(2-피리딜)-1,3-프로판디온 피콜리닉산에틸에스테르 3,5-디(2-피리딜)피라졸 2-피리딘카르복실산,5-메틸-,메틸에스테르(9CI)LY-364947 피콜린아미드 3-(피리딘-2-일)디히드로푸란-2(3H)-온

공급사50 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

上海将来实业股份有限公司400-0066400 13621662912 · [email protected]

上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]

北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]

연결된 노트

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2-Carbomethoxypyridine

기본 정보

개요