データを補完しています。通常は 1 分以内に完了します
基本情報
- CAS
83077-00-3- 標準SMILES
CCOC(C)=NOc1ccc([N+](=O)[O-])cc1- InChIKey
WDZAKURDTBXLAQ-UHFFFAOYSA-N- 分子式
- C10H12N2O4
- 平均分子量
- 224.21 g/mol
- 単同位体質量
- 224.07970687
名称と識別子
- 優先名称
- Ethyl N-(4-nitrophenoxy)ethanimidate
- IUPAC
- ethyl N-(4-nitrophenoxy)ethanimidate
名称と別名
Ethyl N-(4-nitrophenoxy)ethanimidate83077-00-3DTXSID80835812RefChem:596305DTXCID00786554SCHEMBL584845ethyl N-4-nitrophenoxyacetimidateWDZAKURDTBXLAQ-UHFFFAOYSA-Nethyl N-(4-nitrophenoxy)acetimidateethyl N-(4-nitrophenoxy)acetinnidate
データベース識別子
- CAS
83077-00-3- PubChem CID
- 71416420
- DTXSID
DTXSID80835812- EC Number
- 617-436-8
物性
構造計算による物性補完中
- XLogP
- 2.5
- 極性表面積
- 76.6 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 5
- 回転可能結合数
- 4
- 重原子数
- 16
- 形式電荷
- 0
- 複雑度
- 254
安全と法規制
GHS分類
GHS Classification
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.
危険有害性情報
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%)
法規制情報
Regulatory InformationStatus: Active Update: 21-01-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/22597
関連反応
3 件
化合物ノート
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