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5,5-Dimethyl-4-(ethylimino)-3-(alpha,alpha,alpha,4-tetrafluoro-m-tolyl)-2-imidazolidinone

HCID 3022016
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Basic information

CAS
92668-62-7
Standard SMILES
CCN=C1N(c2ccc(F)c(C(F)(F)F)c2)C(=O)NC1(C)C
InChIKey
JANHXFOFNKGBDV-UHFFFAOYSA-N
Molecular formula
C14H15F4N3O
Average molar mass
317.28 g/mol
Monoisotopic mass
317.11512476

Names & identifiers

Preferred name
5,5-Dimethyl-4-(ethylimino)-3-(alpha,alpha,alpha,4-tetrafluoro-m-tolyl)-2-imidazolidinone
IUPAC
5-ethylimino-1-[4-fluoro-3-(trifluoromethyl)phenyl]-4,4-dimethylimidazolidin-2-one

Names & synonyms

BRN 56121605,5-Dimethyl-4-(ethylimino)-3-(alpha,alpha,alpha,4-tetrafluoro-m-tolyl)-2-imidazolidinone2-Imidazolidinone, 4-(ethylimino)-3-(4-fluoro-3-(trifluoromethyl)phenyl)-5,5-dimethyl-2-Imidazolidinone, 5,5-dimethyl-4-(ethylimino)-3-(alpha,alpha,alpha,4-tetrafluoro-m-tolyl)-92668-62-7

Database identifiers

CAS
92668-62-7
PubChem CID
3022016

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
44.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
2
Heavy atoms
22
Formal charge
0
Complexity
475

Related reactions

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Compound notes

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