Basic information
- CAS
237076-72-1- Standard SMILES
O=c1cc[nH]c2cc(C(F)(F)F)cc(C(F)(F)F)c12- InChIKey
VMUHDGVEVRDEMW-UHFFFAOYSA-N- Molecular formula
- C11H5F6NO
- Average molar mass
- 281.15 g/mol
- Monoisotopic mass
- 281.0275331
Names & identifiers
- Preferred name
- 5,7-Bis(trifluoromethyl)-4-hydroxyquinoline
- IUPAC
- 5,7-bis(trifluoromethyl)-1H-quinolin-4-one
- English name
- 5,7-BIS(TRIFLUOROMETHYL)-4-HYDROXYQUINOLINE
- Molecular formula
- C11H5F6NO
- Molecular weight
- 281.15
Names & synonyms
237076-72-15,7-Bis(trifluoromethyl)-4-hydroxyquinoline5,7-bis(trifluoromethyl)quinolin-4-ol5,7-bis(trifluoromethyl)-1H-quinolin-4-one5,7-Bis(trifluoromethyl)quinolin-4(1H)-oneMFCD00153141DTXSID90371170AKOS015852854PS-7229SB68872CS-0328260F727545
Show more names
BUTTPARK 10\01-405,7-bis(trifluoromethyl)-4-Quinolinol4-Quinolinol, 5,7-bis(trifluoromethyl)-
5,7-Bis(trifluoromethyl)quinolin-4-ol, 5,7-Bis(trifluoromethyl)-4-hydroxy-1-azanaphthalene
Database identifiers
- CAS
237076-72-1- PubChem CID
- 2736156
- DTXSID
DTXSID90371170- EC Number
- 670-629-9
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 0
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 399
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 280 · P280-P261-P271
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
- HS Code
- 2933491090 · 2933491090
Safety & regulation
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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- hs_code
- 2933491090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_class
- IRRITANT
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P280-P261-P271
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers4 total
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
Capot Chemical Co., Ltd+86 (0) 571 85 58 67 18
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
上海信旗医药科技有限公司+86-21-54098501 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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