4-Methyl-2,2-bis(trifluoromethyl)imidazolidine--water (1/1)
Basic information
- CAS
64038-68-2- Standard SMILES
CC1CNC(C(F)(F)F)(C(F)(F)F)N1.O- InChIKey
KBLOTQMFQLJJPR-UHFFFAOYSA-N- Molecular formula
- C6H10F6N2O
- Average molar mass
- 240.15 g/mol
- Monoisotopic mass
- 240.06973192
Names & identifiers
- Preferred name
- 4-Methyl-2,2-bis(trifluoromethyl)imidazolidine--water (1/1)
- IUPAC
- 4-methyl-2,2-bis(trifluoromethyl)imidazolidine;hydrate
Names & synonyms
64038-68-2DTXSID109820804-Methyl-2,2-bis(trifluoromethyl)imidazolidine--water (1/1)RefChem:1071069DTXCID9014093452,2-Bis(trifluoromethyl)-4-methylimidazolidine hydrateIMIDAZOLIDINE, 2,2-BIS(TRIFLUOROMETHYL)-4-METHYL-, HYDRATEImidazolidine, 4-methyl-2,2-bis(trifluoromethyl)-, hydrate (1:1)
Database identifiers
- CAS
64038-68-2- PubChem CID
- 46536
- DTXSID
DTXSID10982080
Properties
Computed structural properties
- Topological polar surface area
- 25.1 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 205
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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