Basic information
- CAS
624734-22-1- Standard SMILES
N#Cc1cc(C(F)(F)F)cnc1Cl- InChIKey
BWFBFKPZLKQYPR-UHFFFAOYSA-N- Molecular formula
- C7H2ClF3N2
- Average molar mass
- 206.55 g/mol
- Monoisotopic mass
- 205.9858604
Names & identifiers
- Preferred name
- 2-Chloro-5-(trifluoromethyl)nicotinonitrile
- IUPAC
- 2-chloro-5-(trifluoromethyl)pyridine-3-carbonitrile
- English name
- 2-Chloro-5-trifluoromethyl-nicotinonitrile
- Molecular formula
- C7H2ClF3N2
- Molecular weight
- 206.55
Names & synonyms
2-Chloro-5-(trifluoromethyl)nicotinonitrile624734-22-12-CHLORO-5-(TRIFLUOROMETHYL)PYRIDINE-3-CARBONITRILE2-CHLORO-5-TRIFLUOROMETHYL-NICOTINONITRILEMFCD106976853-Pyridinecarbonitrile, 2-chloro-5-(trifluoromethyl)-SCHEMBL2634852SCHEMBL30055347DTXSID00602129AKOS016003460AB60237AC-29085
Show more names
2-chloro-5-trifluoromethyl nicotinitrile2-chloro-5-(trifluoromethyl)-3-Pyridinecarbonitrile
DS-15859SY0682022-Chloro-3-cyano-5-trifluoromethylpyridine2-chloro-3-cyano-5trifluoromethyl-pyridineDB-073125CS-0131565EN300-3232208F222684
Database identifiers
- CAS
624734-22-1- PubChem CID
- 20071599
- DTXSID
DTXSID00602129
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 36.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 232
Physicochemical properties
- Boiling point
- 251.6 · 251.6±35.0 °C(Predicted)
- Density
- 1.51 · 1.51±0.1 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- pka
- -4.88 · -4.88±0.10(Predicted)
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 280 · P280-P305+P351+P338
- HS Code
- 2933399990 · 2933399990
Safety & regulation
Safety data
- hs_code
- 2933399990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers58 total
上海康恩博医药科技有限公司17510465506 · [email protected]
陕西凯尔凯医药科技有限公司029-2148545164 17392779578 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
宁波振岳医药科技有限公司19817745290 · [email protected]
上海策嵘生物科技有限公司[email protected]
Shaanxi Cuikang Pharmaceutical Technology Co., Ltd+86-13119157289 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
Compound Net Biotechnology Inc.15266686121 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
南京药石科技股份有限公司025-86918202 4000255188 · [email protected]
Allfluoro Pharmaceutical Company Limited+86-400-0216110 +86-15958047586 · [email protected]
陕西宇鼎卓医药科技有限公司18992018580 18165105898 · [email protected]
上海相辉医药科技有限公司13761987713; 13761987713 · [email protected]
Aceschem Inc.+1-817863-6948 +1-（817）863-6948 · [email protected]
上海华思格医药科技有限公司13611612777 · [email protected]
天津津御达化工科技有限公司022-58013646 13011382049 · [email protected]
济南千叶医药技术有限公司0531-81313138 13066006660 · [email protected]
赛纳斯特化学（欢迎点击联系）021-60343070
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
西安峥豪生物科技有限责任公司19829389091 · [email protected]
北京蓝博特科技有限公司010-56330744 18310155299 · [email protected]
北京六合宁远医药科技股份有限公司010-60400365-8001 15910885229 · [email protected]
上海皓之翔生物科技有限公司（原上海拓青化工有限公司）526763801 13301653310 · [email protected]
上海威尔舒氪医药科技有限公司15250615384
西安乐纯化工有限责任公司029-15596886083 15596886083 · [email protected]
北京伊万景瑞生物科技有限公司15866847540 · [email protected]
江西弗莱医药科技有限公司15870833005 · [email protected]
南京药石科技股份有限公司4000255188 · [email protected]
含山捷化生物科技有限公司0555-18055517827 18055517827 · [email protected]
上海炎泽化工有限公司15345144255 19901447308 · [email protected]
上海策嵘生物科技有限公司（定制合成实验室）13062833949 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
河北博新生物科技有限公司19131160546 · [email protected]
西安速加医药科技有限公司029-86115547 17791676824 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
上海玉函化工有限公司021-61469567 13774476675 · [email protected]
ATK CHEMICAL COMPANY LIMITED+undefined-21-51877795 · [email protected]
上海吉至生化科技有限公司021-4009004166/18616739031 18616739031 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
宁波振岳医药科技有限公司0086-19817745290; 19817745290 · [email protected]
Cochemical Co. Ltd.+86-029-86115547 +86-17791676824 · [email protected]
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
10 records
Compound notes
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