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5-(2-Methoxy-1-methyl-vinyl)4-methyl-2-(4-trifluoromethyl-phenyl)-thiazole

HCID 69057017
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COC=C(C)c1sc(-c2ccc(C(F)(F)F)cc2)nc1C
InChIKey
UZDYFVVCFOYLJJ-UHFFFAOYSA-N
Molecular formula
C15H14F3NOS
Average molar mass
313.3 g/mol

Names & identifiers

Preferred name
5-(2-Methoxy-1-methyl-vinyl)4-methyl-2-(4-trifluoromethyl-phenyl)-thiazole
IUPAC
5-(1-methoxyprop-1-en-2-yl)-4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazole

Names & synonyms

5-(2-Methoxy-1-methyl-vinyl)4-methyl-2-(4-trifluoromethyl-phenyl)-thiazoleSCHEMBL44739315-(2-Methoxy-1-methyl-vinyl)-4-methyl-2-(4-trifluoromethyl-phenyl)-thiazole

Database identifiers

PubChem CID
69057017

Properties

Computed structural properties

XLogP
5
Topological polar surface area
50.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
21
Formal charge
0
Complexity
378

Related reactions

5 records
New reaction record
HRID 490736 reaction equation
HRID 490736As productuspto-grants-2009_05
HRID 490737 reaction equation
HRID 490737As reactantuspto-grants-2009_05
HRID 860614 reaction equation
HRID 860614As productuspto-grants-2006_12
HRID 860615 reaction equation
HRID 860615As reactantuspto-grants-2006_12
HRID 1133116 reaction equation
HRID 1133116As reactantTraining data from https://doi.org/10.1039/C8SC04228D (7/10)

Compound notes

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