Basic information
- CAS
872880-66-5- Standard SMILES
Cl.FC(F)(F)c1cc(OC2CCNCC2)ncn1- InChIKey
LRKYAUKEBQYJCK-UHFFFAOYSA-N- Molecular formula
- C10H13ClF3N3O
- Average molar mass
- 283.68 g/mol
- Monoisotopic mass
- 283.0699242
Names & identifiers
- Preferred name
- 4-(Piperidin-4-yloxy)-6-(trifluoromethyl)pyrimidine hydrochloride
- IUPAC
- 4-piperidin-4-yloxy-6-(trifluoromethyl)pyrimidine;hydrochloride
- English name
- 4-(Piperidin-4-yloxy)-6-(trifluoromethyl)pyrimidine hydrochloride
- Molecular formula
- C10H13ClF3N3O
- Molecular weight
- 283.68
Names & synonyms
4-(Piperidin-4-yloxy)-6-(trifluoromethyl)pyrimidine hydrochloride1389313-34-1872880-66-54-piperidin-4-yloxy-6-(trifluoromethyl)pyrimidine;hydrochloride4-(Piperidin-4-yloxy)-6-(trifluoromethyl)pyrimidinehydrochlorideDTXSID20469630LRKYAUKEBQYJCK-UHFFFAOYSA-NMFCD22375757Pyrimidine, 4-(4-piperidinyloxy)-6-(trifluoromethyl)-, hydrochlorideAKOS027390815GS-1954F091384
Show more names
4-(4-piperidyloxy)-6-(trifluoromethyl)pyrimidine;hydrochloride4-[(Piperidin-4-yl)oxy]-6-(trifluoromethyl)pyrimidine--hydrogen chloride (1/1)
Database identifiers
- CAS
872880-66-5- PubChem CID
- 11623348
- DTXSID
DTXSID20469630
Properties
Computed structural properties
- Topological polar surface area
- 47 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 243
Physicochemical properties
- HS Code
- 2933399990 · 2933399990
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2933399990
Chemistry & industry
Suppliers2 total
药明览博(武汉)化学科技有限公司022-59987777 13552403979 · [email protected]
北京新研汇医药研发有限公司13969155946 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…