Basic information
- CAS
18706-21-3- Standard SMILES
O=c1cc(C(F)(F)F)[nH]c2ccc(Cl)cc12- InChIKey
MGEMMMJZAWYWNI-UHFFFAOYSA-N- Molecular formula
- C10H5ClF3NO
- Average molar mass
- 247.6 g/mol
- Monoisotopic mass
- 247.001176
Names & identifiers
- Preferred name
- 6-Chloro-2-(trifluoromethyl)quinolin-4(1H)-one
- IUPAC
- 6-chloro-2-(trifluoromethyl)-1H-quinolin-4-one
- English name
- 6-CHLORO-4-HYDROXY-2-(TRIFLUOROMETHYL)QUINOLINE
- Molecular formula
- C10H5ClF3NO
- Molecular weight
- 247.6
Names & synonyms
18706-21-36-CHLORO-2-(TRIFLUOROMETHYL)QUINOLIN-4(1H)-ONEDTXSID50371474RefChem:307826DTXCID103225086-chloro-2-(trifluoromethyl)quinolin-4-ol6-Chloro-4-hydroxy-2-(trifluoromethyl)quinoline6-chloro-2-(trifluoromethyl)-1H-quinolin-4-oneMFCD00276583SCHEMBL11828378MGEMMMJZAWYWNI-UHFFFAOYSA-NSBB100303
Show more names
BUTTPARK 147\04-654-Quinolinol, 6-chloro-2-(trifluoromethyl)-6-chloro-2-(trifluoromethyl)-4-quinolinolate6-Chloro-2-(trifluoroMethyl) quinoline-4 –ol2-TrifluoroMethyl-4-hydroxy-6-chloroquinoline6-Chloro-4-hydroxy-2-(trifluoromethyl)quinoline97%6-Chloro-4-hydroxy-2-(trifluoromethyl)quinoline 97%
AKOS005254440AKOS009158488AC-7366FS-4276SB71505SY005928DB-044627CS-0084821
Database identifiers
- CAS
18706-21-3
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 339
Physicochemical properties
- Melting point
- 280 °C · 280 °C
- storage temp.
- Sealed in dry,Room Temperature
- Appearance
- White to off-white Solid
- CAS DataBase Reference
- 18706 · 18706-21-3(CAS DataBase Reference)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
- Hazard Codes
- Xi,T
- Risk Statements
- 20 · 20/21/22-36/37/38-25
- Safety Statements
- 26 · 26-36/37/39-45
- HazardClass
- IRRITANT
- HS Code
- 2933499090 · 2933499090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 4 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Safety data
- hs_code
- 2933499090
- risk_code
- 20/21/22-36/37/38-25
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi,T
- safety_code
- 26-36/37/39-45
- hazard_class
- IRRITANT
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Suppliers49 total
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
苏州启航生物科技有限公司18151111370 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海辅欣医药科技有限公司+86-021-021-50872116 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
湖南汇百侍生物科技有限公司0731-85526065 13308475853 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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