Compound C12H16Cl3N5

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

CAS: 24848-47-3

Molecular Formula	`C12H16Cl3N5`
Molecular Weight	336.6 g/mol
LogP	3.5
Topological Polar Surface Area	65.7 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	5
Exact Mass	335.04712
Heavy Atoms	20
Complexity	351.0

Chemical Identifiers

CAS Number	24848-47-3
SMILES	`CCC(C)N(CCC#N)C1=NC(=NC(=N1)C(Cl)(Cl)Cl)C`
InChIKey	`VQDSOUGPNZXCHY-UHFFFAOYSA-N`

📖 Product Overview

Compound C12H16Cl3N5 (CAS: 24848-47-3) is a chemical compound with molecular formula C12H16Cl3N5 and molecular weight 336.6 g/mol. Its IUPAC systematic name is 3-[butan-2-yl-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile. LogP 3.5 Topological Polar Surface Area 65.7 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 5 Rotatable Bonds 5 Exact Mass 335.04712 Heavy Atoms 20 Complexity 351.0 InChI Key: VQDSOUGPNZXCHY-UHFFFAOYSA-N. SMILES: CCC(C)N(CCC#N)C1=NC(=NC(=N1)C(Cl)(Cl)Cl)C.

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