Compound C9H12Cl3N5O

1-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]-3-propan-2-ylurea

CAS: 30863-32-2

Molecular Formula	`C9H12Cl3N5O`
Molecular Weight	312.6 g/mol
LogP	2.2
Topological Polar Surface Area	79.8 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	2
Exact Mass	311.01074
Heavy Atoms	18
Complexity	296.0

Chemical Identifiers

CAS Number	30863-32-2
SMILES	`CC1=NC(=NC(=N1)NC(=O)NC(C)C)C(Cl)(Cl)Cl`
InChIKey	`KVTLGMMNTKWCJH-UHFFFAOYSA-N`

📖 Product Overview

Compound C9H12Cl3N5O (CAS: 30863-32-2) is a chemical compound with molecular formula C9H12Cl3N5O and molecular weight 312.6 g/mol. Its IUPAC systematic name is 1-[4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-yl]-3-propan-2-ylurea. LogP 2.2 Topological Polar Surface Area 79.8 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 2 Exact Mass 311.01074 Heavy Atoms 18 Complexity 296.0 InChI Key: KVTLGMMNTKWCJH-UHFFFAOYSA-N. SMILES: CC1=NC(=NC(=N1)NC(=O)NC(C)C)C(Cl)(Cl)Cl.

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