Furfurylamine, N-methyl-N-(alpha-methyl-m-(trifluoromethyl)phenethyl)-, cyclohexanesulfamate (+-)-

HCID 22103

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 5843-58-3
Standard SMILES: CC(Cc1cccc(C(F)(F)F)c1)[NH+](C)Cc1ccco1.O=S(=O)([O-])NC1CCCCC1
InChIKey: PWABCUPBJMUTBQ-UHFFFAOYSA-N
Molecular formula: C22H31F3N2O4S
Average molar mass: 476.6 g/mol
Monoisotopic mass: 476.19566313

Names & identifiers

Preferred name: Furfurylamine, N-methyl-N-(alpha-methyl-m-(trifluoromethyl)phenethyl)-, cyclohexanesulfamate (+-)-
IUPAC: N-cyclohexylsulfamate;furan-2-ylmethyl-methyl-[1-[3-(trifluoromethyl)phenyl]propan-2-yl]azanium

Names & synonyms

Furfurylamine, N-methyl-N-(alpha-methyl-m-(trifluoromethyl)phenethyl)-, cyclohexanesulfamate (+-)-5843-58-3N-Methyl-N-(alpha-methyl-m-(trifluoromethyl)phenethyl)furfurylamine cyclohexanesulfamateRefChem:345870

Database identifiers

CAS: 5843-58-3
PubChem CID: 22103

Properties

Computed structural properties

Topological polar surface area: 95.2 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 8
Rotatable bonds: 6
Heavy atoms: 32
Formal charge: 0
Complexity: 508

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…