Ethyl N-(4-nitrophenoxy)ethanimidate

HCID 71416420CAS 83077-00-3

기본 정보

표준 SMILES: CCOC(C)=NOc1ccc([N+](=O)[O-])cc1
InChIKey: WDZAKURDTBXLAQ-UHFFFAOYSA-N
분자식: C10H12N2O4
평균 분자량: 224.21 g/mol
단동위원소 질량: 224.07970687

이름 및 식별자

우선 이름: Ethyl N-(4-nitrophenoxy)ethanimidate
IUPAC: ethyl N-(4-nitrophenoxy)ethanimidate

이름 및 동의어

Ethyl N-(4-nitrophenoxy)ethanimidate83077-00-3DTXSID80835812RefChem:596305DTXCID00786554SCHEMBL584845ethyl N-4-nitrophenoxyacetimidateWDZAKURDTBXLAQ-UHFFFAOYSA-Nethyl N-(4-nitrophenoxy)acetimidateethyl N-(4-nitrophenoxy)acetinnidate

데이터베이스 식별자

CAS: 83077-00-3
PubChem CID: 71416420
DTXSID: DTXSID80835812
EC Number: 617-436-8

물성

구조 계산 물성

XLogP: 2.5
극성 표면적: 76.6 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 5
회전 가능 결합 수: 4
무거운 원자 수: 16
형식 전하: 0
복잡도: 254

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]；H311 (100%): Toxic in contact with skin [Danger Acute toxicity, dermal]；H331 (100%): Toxic if inhaled [Danger Acute toxicity, inhalation]；H411 (100%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

P261, P262, P264, P270, P271, P273, P280, P301+P316, P302+P352, P304+P340, P316, P321, P330, P361+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Regulatory InformationStatus: Active Update: 21-01-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/22597

Hazard Classes and CategoriesAcute Tox. 3 (100%)；Acute Tox. 3 (100%)；Acute Tox. 3 (100%)；Aquatic Chronic 2 (100%)

규제 정보