아세타미프리드

N-((6-Chloro-3-pyridinyl)methyl)-N'-cyano-N-methylethanimidamide

HCID 213021
노트반응
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기본 정보

CAS
135410-20-7
표준 SMILES
CC(=NC#N)N(C)Cc1ccc(Cl)nc1
InChIKey
WCXDHFDTOYPNIE-UHFFFAOYSA-N
분자식
C10H11ClN4
평균 분자량
222.67 g/mol
단동위원소 질량
222.06722403

개요

Acetamiprid is a carboxamidine that is acetamidine in which the amino hydrogens are substituted by a (6-chloropyridin-3-yl)methyl and a methyl group while the hydrogen attached to the imino nitrogen is replaced by a cyano group. It has a role as a neonicotinoid insectide, a xenobiotic and an environmental contaminant. It is a nitrile, a carboxamidine and a monochloropyridine. It is functionally related to a 2-chloropyridine.

이름 및 식별자

우선 이름
N-((6-Chloro-3-pyridinyl)methyl)-N'-cyano-N-methylethanimidamide
IUPAC
N-[(6-chloro-3-pyridinyl)methyl]-N'-cyano-N-methylethanimidamide
현지명
아세타미프리드
영어명
Acetamiprid
분자식
C10H11ClN4
분자량
222.67

이름 및 동의어

160430-64-8DTXSID901015148N-((6-Chloro-3-pyridinyl)methyl)-N'-cyano-N-methylethanimidamideN-[(6-chloro-3-pyridinyl)methyl]-N'-cyano-N-methylethanimidamideRefChem:1090707DTXCID8014300Acetamiprid135410-20-7IntruderMospilanAssailPiorun
이름 더 보기
아세타미프리드트랜스-N-(6-클로로-3-피리지르메틸)-N'-시아노-N-메치르아세트아미진피오런MORTALMOSPILDATEacetamipriACETAMIPRIISSACETAMIPRID 95%TC(E/Z)-AcetamipridAcetamiprid20%SP/Mospilan20Acetamiprid20%SP/Mospilan20SP
StonkatPrize(E)-N-((6-Chloropyridin-3-yl)methyl)-N'-cyano-N-methylacetimidamideN-[(6-chloropyridin-3-yl)methyl]-N'-cyano-N-methylethanimidamideAcetamiprid [ISO]NI 25(E)-acetamiprid(Z)-acetamiprid

데이터베이스 식별자

CAS
135410-20-7、160430-64-8
PubChem CID
213021
DTXSID
DTXSID901015148
ChEMBL
CHEMBL3185634
ChEBI
CHEBI:39163
UNII
5HL5N372P0
EC Number
682-791-8
Nikkaji
J1.112.167E、J682.238J

물성

구조 계산 물성

XLogP
1.4
극성 표면적
52.3 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
3
회전 가능 결합 수
3
무거운 원자 수
15

실험 및 물리화학적 성질

Pesticides · 3건

Pesticides

Insecticides

Environmental transformation -> Pesticides (parent, predecessor)

LogP0.8
Collision Cross Section · 3건

155.1 Ų [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: APCI+; Dataset: TOXCAST; Source Identifier: DTXSID0034300]

150.24 Ų [M+H]+ [CCS Type: TW]

157.86 Ų [M+Na]+

물리화학적 성질

녹는점
100 · 100-102°C
끓는 점
352.38 · 352.380±52.00 °C(Press: 760.00 Torr)(predicted)
밀도
1.174 · 1.174±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
저장 조건
2 · 2-8°C
산도 계수 (pKa)
-0.44 · -0.440±0.10(predicted)
주요 응용
농업환경

안전 및 규제

GHS 분류

GHS Classification · 6건

Danger

H301: Toxic if swallowed [Danger Acute toxicity, oral]

P203, P264, P270, P273, P280, P301+P316, P318, P321, P330, P391, P405, and P501 (click each P-code to see the statement)

Danger

H301 (97.4%): Toxic if swallowed [Danger Acute toxicity, oral]

P260, P264, P270, P271, P273, P284, P301+P316, P304+P340, P316, P320, P321, P330, P403+P233, P405, and P501 (click each P-code to see the statement)

유해성 정보

Hazard Classes and Categories · 3건

Acute Tox. 3 (97.4%)

Acute toxicity (Oral) - Category 3

Repr. 2

안전 데이터

wgk
3
rtecs
KJ4235200
ridadr
UN 2811
독성
LD50 in male, female rats, male, female mice (mg/kg): 217, 146, 198, 184 orally (Takahashi)
risk_code
23/25-57
hazard_code
T

화학 및 산업

용도 및 제조

Use Classification · 2건

Insecticides

Environmental transformation -> Pesticides (parent, predecessor)

응용 분야

용도Insecticide.

상·하류 제품 정보

공급사100 곳

湖北博杰生物科技有限公司0713-2060728 15629612610
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
河北创海生物科技有限公司+86-86-13131129325 · [email protected]

추가 설명

정의ChEBI: A carboxamidine that is acetamidine in which the amino hydrogens are substituted by a (6-chloropyridin-3-yl)methyl and a methyl group while the hydrogen attached to the imino nitrogen is replaced by a cyano group.

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