Benzenamine, 2-ethyl-N-(2-methoxy-1-methylethyl)-6-methyl-

HCID 65298CAS 51219-00-2

기본 정보

표준 SMILES: CCc1cccc(C)c1NC(C)COC
InChIKey: YXWIRQHVEQIJOV-UHFFFAOYSA-N
분자식: C13H21NO
평균 분자량: 207.31 g/mol
단동위원소 질량: 207.16231429

이름 및 식별자

우선 이름: Benzenamine, 2-ethyl-N-(2-methoxy-1-methylethyl)-6-methyl-
IUPAC: 2-ethyl-N-(1-methoxypropan-2-yl)-6-methylaniline
영어명: 2-ethyl-N-(2-methoxyisopropyl)-6-methylaniline
분자식: C13H21NO
분자량: 207.31

이름 및 동의어

2-Ethyl-N-(2-methoxyisopropyl)-6-methylanilineBenzenamine, 2-ethyl-N-(2-methoxy-1-methylethyl)-6-methyl-DeschloroacetylmetolachlorEINECS 257-061-3DTXSID108859462-Ethyl-6-methyl-N-(1'-methyl-2-methoxyethyl)anilineRefChem:561693DTXCID901025301257-061-351219-00-22-ethyl-N-(1-methoxypropan-2-yl)-6-methylanilineMFCD16787883

이름 더 보기

N-(1-Methoxy-2-propyl)-2-ethyl-6-methylaniline2-Ethyl-6-methyl-N-(1'-methoxy-2'-propyl)anilineN-(1-Methyl-2-methoxyethyl)-2-ethyl-6-methylaniline2-Ethyl-N-(2-methoxy-1-methylethyl)-6-methylanilineMetolachlor-des(chloroacetyl) 100 μg/mL in Acetonitrile

2-Ethyl-N-(2-methoxy-1-methylethyl)-6-methyl-benzenamine2-?Ethyl-?N-?(2-?methoxy-?1-?methylethyl)?-?6-?methyl-benzenamine2-Ethyl-N-(2-methoxy-1-methylethyl)-6-methylbenzenamine; 2-Ethyl-6-methyl-N-(1'-methoxy-2'-propyl)aniline; Deschloroacetylmetolachlor; N-(1-Methoxy-2-propyl)-2-ethyl-6-methylanilineMetolachlor des(chloroacetyl)Metolachlor-des(chloroacetyl)SCHEMBL3466659YXWIRQHVEQIJOV-UHFFFAOYSA-NBCA21900

데이터베이스 식별자

CAS: 51219-00-2
PubChem CID: 65298
DTXSID: DTXSID10885946
EC Number: 257-061-3
Nikkaji: J261.661K

물성

구조 계산 물성

XLogP: 3.4
극성 표면적: 21.3 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 5
무거운 원자 수: 15
형식 전하: 0
복잡도: 172

물리화학적 성질

끓는 점: 315.9 · 315.9±37.0 °C(Predicted)
밀도: 0.967 · 0.967±0.06 g/cm3(Predicted)
용해도: 디클로로메탄，메탄올，톨루엔에 용해됨
물리적 상태: 기름
산도 계수 (pKa): 4.74 · 4.74±0.50(Predicted)
색상: 노란색
EPA: 2 · Benzenamine, 2-ethyl-N-(2-methoxy-1-methylethyl)-6-methyl- (51219-00-2)

안전 및 규제

GHS 분류

GHS Classification · 3건

H412 (100%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

P273, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 29 reports by companies from 2 notifications to the ECHA C&L Inventory.

유해성 정보

Hazard Classes and CategoriesAquatic Chronic 3 (100%)

안전 데이터

tsca: TSCA listed

화학 및 산업

용도 및 제조

General Manufacturing InformationBenzenamine, 2-ethyl-N-(2-methoxy-1-methylethyl)-6-methyl-: INACTIVE

응용 분야 · 1건

용도2-Ethyl-N-(2-methoxy-1-methylethyl)-6-methyl-benzenamine is an intermediate in synthesizing Metolachlor (M338700), an acyanilide herbicide similar to selective pre-emergence herbicides (1). It is a contaminant in the groundwater and potential pollutant (2). This compound is a contaminant of emerging concern (CECs). Drinking water contaminant candidate list 3 (CCL 3) compound as per United States Environmental Protection Agency (EPA), environmental, and food contaminants.

공급사15 곳

南京世洲生物科技有限公司025-025-85560043 17301488900 · [email protected]

上海赛可锐生物科技有限公司021-58000709 13120558703 · [email protected]

广东元丰化学试剂有限公司0751-2829979 13318593351 · [email protected]

北京欣恒研科技有限公司010-56034419 13426091577

上海艾梯西生物科技有限公司18721763493

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