2-Amino-5-chloro-6-methylpyridine

HCID 12251007CAS 36936-23-9

기본 정보

표준 SMILES: Cc1nc(N)ccc1Cl
InChIKey: SHIKRPPKGCWKJO-UHFFFAOYSA-N
분자식: C6H7ClN2
평균 분자량: 142.58 g/mol
단동위원소 질량: 142.0297759

이름 및 식별자

우선 이름: 2-Amino-5-chloro-6-methylpyridine
IUPAC: 5-chloro-6-methylpyridin-2-amine
영어명: 2-Amino-5-chloro-6-picoline
분자식: C6H7ClN2
분자량: 142.59

이름 및 동의어

2-AMINO-5-CHLORO-6-METHYLPYRIDINERefChem:464558803-766-15-chloro-6-methylpyridin-2-amine36936-23-95-CHLORO-6-METHYL-2-PYRIDINAMINEMFCD094533356-Amino-3-chloropicoline2-Amino-5-chloro-6-picoline2-Pyridinamine, 5-chloro-6-methyl-2-Amino-5-Chloro-6-Methyl PyridineSCHEMBL558598

이름 더 보기

6-Amino-3-chloropicolline2-AMINO 5-CHLORO PICOLINE2-Amino-5-chloro-6-methylpyridi6-Amino-3-chloro-2-methylpyridine5-Chloro-6-methyl-2-aminopyridine

6-Amino-3-chloro-2-picoline5-chloro-6-methyl-pyridineamineDTXSID50482438SHIKRPPKGCWKJO-UHFFFAOYSA-N5-chloro-6-methyl-pyridin-2-amineSTL119698AKOS000108170AB50593

데이터베이스 식별자

CAS: 36936-23-9
PubChem CID: 12251007
DTXSID: DTXSID50482438
EC Number: 803-766-1

물성

구조 계산 물성

XLogP: 1.5
극성 표면적: 38.9 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 0
무거운 원자 수: 9
형식 전하: 0
복잡도: 97

물리화학적 성질

녹는점: 70 · 70-75℃
끓는 점: 234.2 · 234.2±35.0 °C(Predicted)
밀도: 1.26 · 1.260±0.06 g/cm3(Predicted)
저장 조건: 2 · Keep in dark place,Inert atmosphere,2-8°C
물리적 상태: powder to crystal
산도 계수 (pKa): 4.83 · 4.83±0.37(Predicted)
색상: White to Orange to Green
InChI: InChI=1S/C6H7ClN2/c1-4-5(7)2-3-6(8)9-4/h2-3H,1H3,(H2,8,9)
InChIKey: SHIKRPPKGCWKJO-UHFFFAOYSA-N
SMILES: C1(N)=NC(C)=C(Cl)C=C1

화학적 성질

Solid

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H302 (97.6%): Harmful if swallowed [Warning Acute toxicity, oral]；H318 (97.6%): Causes serious eye damage [Danger Serious eye damage/eye irritation]

P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P330, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 41 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.