2-Methylthio-4-(2,2,2-trifluoroethoxy)pyrimidine

HCID 19694186
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Basic information

Standard SMILES
CSc1nccc(OCC(F)(F)F)n1
InChIKey
UHSFLWCDGCSLFW-UHFFFAOYSA-N
Molecular formula
C7H7F3N2OS
Average molar mass
224.21 g/mol

Names & identifiers

Preferred name
2-Methylthio-4-(2,2,2-trifluoroethoxy)pyrimidine
IUPAC
2-methylsulfanyl-4-(2,2,2-trifluoroethoxy)pyrimidine

Names & synonyms

2-methylthio-4-(2,2,2-trifluoroethoxy)pyrimidineSCHEMBL14370912-(methylthio)-4-(2,2,2-trifluoroethoxy)pyrimidine

Database identifiers

PubChem CID
19694186

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
60.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
3
Heavy atoms
14

Related reactions

4 records
New reaction record

Linked notes

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