[5-(Trifluoromethyl)pyridin-2-yl]methanamine

HCID 3796375CAS 164341-39-3

기본 정보

표준 SMILES: NCc1ccc(C(F)(F)F)cn1
InChIKey: HVQOLQUEKRHKKJ-UHFFFAOYSA-N
분자식: C7H7F3N2
평균 분자량: 176.14 g/mol
단동위원소 질량: 176.05613288

이름 및 식별자

우선 이름: [5-(Trifluoromethyl)pyridin-2-yl]methanamine
IUPAC: [5-(trifluoromethyl)-2-pyridinyl]methanamine
영어명: 5-(Trifluoromethyl)-2-pyridinemethanamine
분자식: C7H7F3N2
분자량: 176.14

이름 및 동의어

164341-39-3(5-(trifluoromethyl)pyridin-2-yl)methanamine[5-(trifluoromethyl)pyridin-2-yl]methanamine5-(TRIFLUOROMETHYL)-2-PYRIDINEMETHANAMINEDTXSID00396536RefChem:403710DTXCID90347395853-211-22-Pyridinemethanamine, 5-(trifluoromethyl)-2-Aminomethyl-5-(trifluoromethyl)pyridineMFCD04117761(5-Trifluoromethylpyridin-2-yl)methylamine

이름 더 보기

CAS:164341-39-3Methyl-(5-trifluoroMethyl-pyridin-2-yl)-aMine2-Aminomethyl-5-(trifluoromethyl)pyridine hydrochloride

C-(5-TRIFLUOROMETHYL-PYRIDIN-2-YL)-METHYLAMINE2-(Aminomethyl)-5-(trifluoromethyl)pyridine1-[5-(TRIFLUOROMETHYL)PYRIDIN-2-YL]METHANAMINE[5-(trifluoromethyl)-2-pyridyl]methanamine[5-(TRIFLUOROMETHYL)PYRIDIN-2-YL]METHYLAMINE(5-(trifluoromethyl)pyridin-2-yl)methylamineC-(5-TRIFLUOROMETHYL-PYRIDIN-2-YL)METHYLAMINE HCLSCHEMBL2550872

데이터베이스 식별자

CAS: 164341-39-3
PubChem CID: 3796375
DTXSID: DTXSID00396536
EC Number: 853-211-2

물성

구조 계산 물성

XLogP: 0.6
극성 표면적: 38.9 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 5
회전 가능 결합 수: 1
무거운 원자 수: 12
형식 전하: 0
복잡도: 146

물리화학적 성질

끓는 점: 200.3 · 200.3±35.0 °C(Predicted)
밀도: 1.293 · 1.293±0.06 g/cm3(Predicted)
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
산도 계수 (pKa): 8.27 · 8.27±0.39(Predicted)

화학적 성질

white solid

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.