3-[Butan-2-yl-[4-propyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile

HCID 32729

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 24863-54-5
Standard SMILES: CCCc1nc(N(CCC#N)C(C)CC)nc(C(Cl)(Cl)Cl)n1
InChIKey: UGZFESLBFCQWDV-UHFFFAOYSA-N
Molecular formula: C14H20Cl3N5
Average molar mass: 364.7 g/mol
Monoisotopic mass: 363.078429

Names & identifiers

Preferred name: 3-[Butan-2-yl-[4-propyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile
IUPAC: 3-[butan-2-yl-[4-propyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile

Names & synonyms

3-[butan-2-yl-[4-propyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile24863-54-5DTXSID302750023-{(Butan-2-yl)[4-propyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino}propanenitrile

Database identifiers

CAS: 24863-54-5
PubChem CID: 32729
DTXSID: DTXSID30275002
Nikkaji: J1.611.747A

Properties

Computed structural properties

XLogP: 4.3
Topological polar surface area: 65.7 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 5
Rotatable bonds: 7
Heavy atoms: 22
Formal charge: 0
Complexity: 378

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…