基本情報
- CAS
1206977-80-1- 標準SMILES
FC(F)Oc1cccnc1Cl- InChIKey
HPJAGIYYNJKTOR-UHFFFAOYSA-N- 分子式
- C6H4ClF2NO
- 平均分子量
- 179.55 g/mol
- 単同位体質量
- 178.9949478
名称と識別子
- 優先名称
- 2-Chloro-3-(difluoromethoxy)pyridine
- IUPAC
- 2-chloro-3-(difluoromethoxy)pyridine
- 現地名
- 2-クロロ-3-(ジフルオロメトキシ)ピリジン
- 英語名
- 2-chloro-3-(difluoroMethoxy)pyridine
- 分子式
- C6H4ClF2NO
- 分子量
- 179.55
名称と別名
2-chloro-3-(difluoromethoxy)pyridine1206977-80-1RefChem:86178823-555-8MFCD13185847SCHEMBL189015DTXSID501291526AKOS014313012CS-W007002DS-8480SB12725SY028173
名称をさらに表示
2-クロロ-3-(ジフルオロメトキシ)ピリジン2-Chloro-3-(difluoromthoxy)pyridinPyridine, 2-chloro-3-(difluoromethoxy)-
EN300-126701F2147-1618A892124SCHEMBL29186861SCHEMBL30320472F364123A1-074362-chloro-3-(difluoromethoxy)pyridine, AKOS014313012, AK146244, I02-2909, 1206977-80-1
データベース識別子
- CAS
1206977-80-1- PubChem CID
- 53302035
- DTXSID
DTXSID501291526- EC Number
- 823-555-8
物性
構造計算による物性
- XLogP
- 2.2
- 極性表面積
- 22.1 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 4
- 回転可能結合数
- 2
- 重原子数
- 11
- 形式電荷
- 0
- 複雑度
- 125
物理化学的性質
- 貯蔵温度
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- 外見
- liquid
- 色
- Clear, faint lemon
- InChI
- InChI=1S/C6H4ClF2NO/c7-5-4(11-6(8)9)2-1-3-10-5/h1-3,6H
- InChIKey
- HPJAGIYYNJKTOR-UHFFFAOYSA-N
- SMILES
- C1(Cl)=NC=CC=C1OC(F)F
安全と法規制
安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。
GHS分類
GHS Classification
Warning
H302+H312+H332 (93.3%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]；H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (96.7%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (96.7%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 30 reports by companies from 3 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
Hazard Classes and CategoriesAcute Tox. 4 (100%)；Acute Tox. 4 (96.7%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；Acute Tox. 4 (96.7%)；STOT SE 3 (100%)
安全データ
- hs_code
- 2933399990
化学と産業
上流・下流製品情報
上流原料
サプライヤー63 社
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
上海凌凯科技股份有限公司58950110 13124863828 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
上海硅兰医药科技有限公司17301772648; 17301772648 · [email protected]
安徽合诺生物科技有限公司0555-2761852
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
安徽合诺生物科技有限公司
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