2,4-dichloro-6-ethyl-1,3,5-triazine

C5H5Cl2N3 — CID 12776

IUPAC2,4-dichloro-6-ethyl-1,3,5-triazine
SMILESCCc1nc(Cl)nc(Cl)n1
InChIInChI=1S/C5H5Cl2N3/c1-2-3-8-4(6)10-5(7)9-3/h2H2,1H3
InChIKeyADVXAMGGIRUOKU-UHFFFAOYSA-N
MW178.02 g/mol
LogP1.74
Rot. Bonds1

About 2,4-dichloro-6-ethyl-1,3,5-triazine

2,4-dichloro-6-ethyl-1,3,5-triazine (PubChem CID 12776) has the molecular formula C5H5Cl2N3 and a molecular weight of 178.02 g/mol. Its IUPAC name is 2,4-dichloro-6-ethyl-1,3,5-triazine.

Molecular Properties

Compound Name2,4-dichloro-6-ethyl-1,3,5-triazine
PubChem CID12776
Molecular FormulaC5H5Cl2N3
Molecular Weight178.02 g/mol
Exact Mass176.99
IUPAC Name2,4-dichloro-6-ethyl-1,3,5-triazine
SMILESCCc1nc(Cl)nc(Cl)n1
InChIInChI=1S/C5H5Cl2N3/c1-2-3-8-4(6)10-5(7)9-3/h2H2,1H3
InChIKeyADVXAMGGIRUOKU-UHFFFAOYSA-N
XLogP1.74
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.02
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-Ethyl-1,3,5-triazine-2,4-diamine
CID 13628
2,4-Dichloro-6-methyl-1,3,5-triazine
CID 16083
4-Chloro-6-methyl-1,3,5-triazin-2-amine
CID 30591
2,4-Dichloro-6-(propan-2-yl)-1,3,5-triazine
CID 35648
2,4,6-Triethyltriazine
CID 13889
s-Triazine, 2-(2-bromoethyl)-4,6-dichloro-
CID 16206234
2,4-Dichloro-6-cyclopropyl-1,3,5-triazine
CID 18965220
2-Chloro-4-ethyl-6-propan-2-yl-1,3,5-triazine
CID 87676010
2-Chloro-4,6-diethyl-1,3,5-triazine
CID 12795
2-Ethyl-4,6-bis(trichloromethyl)-1,3,5-triazine
CID 19198
2,4-Diethyl-6-(trichloromethyl)-1,3,5-triazine
CID 35200
2-Chloro-4,6-dimethyl-1,3,5-triazine
CID 35658

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-6-ethyl-1,3,5-triazine?
The IUPAC name of 2,4-dichloro-6-ethyl-1,3,5-triazine (CID 12776) is 2,4-dichloro-6-ethyl-1,3,5-triazine.
What is the SMILES notation for 2,4-dichloro-6-ethyl-1,3,5-triazine?
The canonical SMILES for 2,4-dichloro-6-ethyl-1,3,5-triazine is CCc1nc(Cl)nc(Cl)n1.
What is the InChIKey of 2,4-dichloro-6-ethyl-1,3,5-triazine?
The InChIKey is ADVXAMGGIRUOKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5Cl2N3/c1-2-3-8-4(6)10-5(7)9-3/h2H2,1H3.
What are the key properties of 2,4-dichloro-6-ethyl-1,3,5-triazine?
2,4-dichloro-6-ethyl-1,3,5-triazine has a molecular weight of 178.02 g/mol, XLogP of 1.74, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-6-ethyl-1,3,5-triazine is sourced from PubChem (CID 12776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).