N-[(6-클로로피리딘-3-일)메틸]-N-메틸라민

6-Chloro-N-methyl-3-pyridinemethanamine

HCID 11094883

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 120739-62-0
표준 SMILES: CNCc1ccc(Cl)nc1
InChIKey: XALCOJXGWJXWBL-UHFFFAOYSA-N
분자식: C7H9ClN2
평균 분자량: 156.61 g/mol
단동위원소 질량: 156.045426

이름 및 식별자

우선 이름: 6-Chloro-N-methyl-3-pyridinemethanamine
IUPAC: 1-(6-chloro-3-pyridinyl)-N-methylmethanamine
현지명: N-[(6-클로로피리딘-3-일)메틸]-N-메틸라민
영어명: N-[(6-CHLOROPYRIDIN-3-YL)METHYL]-N-METHYLAMINE
분자식: C7H9ClN2
분자량: 156.61

이름 및 동의어

120739-62-0[(6-chloropyridin-3-yl)methyl](methyl)amine6-CHLORO-N-METHYL-3-PYRIDINEMETHANAMINEDTXSID301024729((6-chloropyridin-3-yl)methyl)(methyl)amineRefChem:541893DTXCID201508914819-914-3N-[(6-chloropyridin-3-yl)methyl]methylamineN-[(6-chloropyridin-3-yl)methyl]-N-methylamine1-(6-CHLOROPYRIDIN-3-YL)-N-METHYLMETHANAMINEAcetamiprid metabolite IM-1-4

이름 더 보기

N-[(6-클로로피리딘-3-일)메틸]-N-메틸라민Acetamiprid Impurity 2Acetamiprid impurities51-(6-chloro-3-pyridinyl)-N-methylmethanamine

MFCD098021592-CHLORO-5-(METHYLAMINOMETHYL)PYRIDINE1-(6-Chloro-3-pyridinyl)-N-MethylMethanaMine 1.4 HCl2-chloro-5(methylaminomethyl)pyridineAS-107173-Pyridinemethanamine, 6-chloro-N-methyl-acetamiprid TP16-Chloro-N-methyl-3-pyridinemethanamine; 1-(6-Chloropyridin-3-yl)-N-methylmethanamine; 2-Chloro-5-(methylaminomethyl)pyridine; N-(6-Chloro-3-pyridylmethyl)-N-methylamine; N-[(6-Chloropyridin-3-yl)methyl]methylamine

데이터베이스 식별자

CAS: 120739-62-0
PubChem CID: 11094883
DTXSID: DTXSID301024729
EC Number: 819-914-3
Nikkaji: J969.020D

물성

구조 계산 물성

XLogP: 1.2
극성 표면적: 24.9 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 2
무거운 원자 수: 10
형식 전하: 0
복잡도: 97

물리화학적 성질

끓는 점: 236.9 · 236.9±25.0 °C(Predicted)
밀도: 1.149 · 1.149±0.06 g/cm3(Predicted)
저장 조건: -20 °C · Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
용해도: DMSO(약간 용해됨), 메탄올(약간 용해됨)
물리적 상태: 고체
산도 계수 (pKa): 8.08 · 8.08±0.10(Predicted)
색상: 맑은 담황색 오일에서 미색에서 담황색까지

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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

유해성 정보

Hazard Classes and CategoriesAcute Tox. 3 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)

안전 데이터

HS 번호: 2933399990
risk_code: 22
hazard_code: Xn
위험 등급: IRRITANT
기존화학 물질: 2014-3-5864

화학 및 산업

용도 및 제조

Use ClassificationEnvironmental transformation -> Pesticide transformation products (metabolite, successor)

응용 분야

용도N-[(6-Chloropyridin-3-yl)methyl]methylamine is a metabolite of Acetamiprid (A158000), a novel neonicotinid insecticide against Holotrichia consanguinea in sugarcane.