5-Amino-2-chloropyridine

HCID 79305CAS 5350-93-6

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: Nc1ccc(Cl)nc1
InChIKey: QAJYCQZQLVENRZ-UHFFFAOYSA-N
분자식: C5H5ClN2
평균 분자량: 128.56 g/mol
단동위원소 질량: 128.01412584

개요

3-Amino-6-chloropyridine is an aminopyridine.

이름 및 식별자

우선 이름: 5-Amino-2-chloropyridine
IUPAC: 6-chloropyridin-3-amine
영어명: 5-Amino-2-chloropyridine
분자식: C5H5ClN2
분자량: 128.56

이름 및 동의어

5-Amino-2-chloropyridine5350-93-6NSC 81DTXSID40201716EINECS 226-322-3RefChem:532170DTXCID70124207226-322-36-chloropyridin-3-amine2-Chloro-5-aminopyridine3-Amino-6-chloropyridine3-Pyridinamine, 6-chloro-

이름 더 보기

AMINO CHLOROPYRIDINETobrasix5-Amino-2-chLTIMTEC-BB SBB0042345-Amino-2-chlorpyridin2-Chloro-5-pyridinamine

MFCD000062436-Chloro-3-pyridinamine6-Chloro-pyridin-3-ylamine6-chloro-3-pyridylamine5-amino-2-chloro pyridineUNII-386QR22KDZ386QR22KDZNSC-81

데이터베이스 식별자

CAS: 5350-93-6
PubChem CID: 79305
DTXSID: DTXSID40201716
ChEBI: CHEBI:194601
UNII: 386QR22KDZ
EC Number: 226-322-3
Nikkaji: J81.013D

물성

구조 계산 물성

XLogP: 1.1
극성 표면적: 38.9 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 0
무거운 원자 수: 8
형식 전하: 0
복잡도: 76.8

물리화학적 성질

녹는점: 81 · 81-83 °C(lit.)
끓는 점: 205.39 °C · 205.39°C (rough estimate)
밀도: 1.2417 · 1.2417 (rough estimate)
굴절률: 1.511 · 1.5110 (estimate)
저장 조건: Keep in dark place,Inert atmosphere,Room temperature
물리적 상태: powder to crystal
산도 계수 (pKa): 1.94 · 1.94±0.10(Predicted)
색상: 흰색에서 갈색으로
BRN: 108891 · 108891
InChI: InChI=1S/C5H5ClN2/c6-5-2-1-4(7)3-8-5/h1-3H,7H2
InChIKey: QAJYCQZQLVENRZ-UHFFFAOYSA-N
SMILES: C1=NC(Cl)=CC=C1N

화학적 성질

Light yellow to brown crystalline 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 77 reports by companies from 9 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: 29333999
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36-37/39
위험 등급: IRRITANT
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

응용 분야 · 2건

용도5-Amino-2-chloropyridine was used in the synthesis of [2H5]2-amino-l-methyl-6-phenylimidazo[4,5-b]pyridine. It was used in identification and evaluation of molecularly imprinted polymers for the selective removal of potentially genotoxic aminopyridine impurities from pharmaceuticals.

일반 설명5-Amino-2-chloropyridine undergoes Suzuki-Miyaura coupling with sterically hindered 2,6-dimethylphenylboronic acid. It undergoes facile temperature dependent displacement of chloride by bromide via Sandmeyer reaction to yield 2,5-dibromopyridine.

공급사50 곳

北京华美互利生物化工010-56205725 · [email protected]

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]

上海泰矶林实业有限公司02150630626 17717886015 · [email protected]

T&W GROUP021-61551611 13296011611 · [email protected]

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