1-[3-Chloro-5-(trifluoromethyl)pyridin-2-yl]methanamine hydrochloride

HCID 11499744

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 175277-74-4
표준 SMILES: Cl.NCc1ncc(C(F)(F)F)cc1Cl
InChIKey: DIEGHTBYTFRSDU-UHFFFAOYSA-N
분자식: C7H7Cl2F3N2
평균 분자량: 247.04 g/mol
단동위원소 질량: 245.9938381

개요

[3-Chloro-5-(trifluoromethyl)-2-pyridyl]methylamine hydrochloride is an aminoalkylpyridine.

이름 및 식별자

우선 이름: 1-[3-Chloro-5-(trifluoromethyl)pyridin-2-yl]methanamine hydrochloride
IUPAC: [3-chloro-5-(trifluoromethyl)-2-pyridinyl]methanamine;hydrochloride
영어명: 2-(Aminomethyl)-3-chloro-5-(trifluoromethyl)-pyridine hydrochloride
분자식: C7H6ClF3N2
분자량: 210.58

이름 및 동의어

326476-49-71-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methanamine hydrochloride1-(3-chloro-5-(trifluoromethyl)pyridin-2-yl)methanamine hydrochlorideRefChem:423579640-341-8(3-Chloro-5-(trifluoromethyl)pyridin-2-yl)methanamine hydrochloride2-(Aminomethyl)-3-chloro-5-(trifluoromethyl)pyridine hydrochloride2-aminomethyl-3-chloro-5-(trifluoromethyl)pyridine hydrochlorideMFCD00210134[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methanamine Hydrochloride2-(AMINOMETHYL)-3-CHLORO-5-(TRIFLUOROMETHYL)-PYRIDINE HYDROCHLORIDE[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methanamine;hydrochloride

이름 더 보기

(3-chloro-5-(trifluoromethyl)pyridin-2-yl)methanamineBUTTPARK 145\04-452-(Aminomethyl)-3-chloro-5-(trifluoromethyl)-2-Aminomethyl-3-chloro-5-(trifluoromethyl)pyridine3-Chloro-5-(trifluoromethyl)-2-pyridinemethanamine2-Pyridinemethanamine,3-chloro-5-(trifluoromethyl)-3-chloro-5-(trifluoromethyl)pyridinyl-2-methanamine2-AMinoMethyl-3-chloro-5-(trifluoroMethyl)pyridine HCl1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methanamine2-AMINOMETHYL-3-CHLORO-5-TRIFLUOROMETHYL PYRIDINE HCL SALT

[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDYL]METHYLAMINE HYDROCHLORIDE209919-84-61-[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]methanamine hydrochloride (1:1)(3-CHloro-5-(trifluoromethyl)pyridin-2-yl)methanamine xhydrochlorideSCHEMBL637924SCHEMBL6157878DTXSID50938642CHEBI:194644

데이터베이스 식별자

CAS: 175277-74-4、326476-49-7
PubChem CID: 11499744
DTXSID: DTXSID50938642
ChEBI: CHEBI:194644
EC Number: 640-341-8

물성

구조 계산 물성

극성 표면적: 38.9 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 5
회전 가능 결합 수: 1
무거운 원자 수: 14
형식 전하: 0
복잡도: 174

물리화학적 성질

녹는점: 226 °C · 226 °C
끓는 점: 212 · 212.0±35.0℃ (760 Torr)
밀도: 1.421 · 1.421±0.06 g/cm3 (20 ºC 760 Torr)
인화점: 82 · 82.0±25.9℃
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
산도 계수 (pKa): 7.85 · 7.85±0.50(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H301 (50%): Toxic if swallowed [Danger Acute toxicity, oral]

P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P319, P321, P330, P332+P317, P337+P317, P361+P364, 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.