2,4-dichloro-6-phenoxy-1,3,5-triazine;ethane

C11H11Cl2N3O — CID 91071262

IUPAC2,4-dichloro-6-phenoxy-1,3,5-triazine;ethane
SMILESCC.Clc1nc(Cl)nc(Oc2ccccc2)n1
InChIInChI=1S/C9H5Cl2N3O.C2H6/c10-7-12-8(11)14-9(13-7)15-6-4-2-1-3-5-6;1-2/h1-5H;1-2H3
InChIKeyRBJUFMGJGKVKQI-UHFFFAOYSA-N
MW272.14 g/mol
LogP4.00
Rot. Bonds2

About 2,4-dichloro-6-phenoxy-1,3,5-triazine;ethane

2,4-dichloro-6-phenoxy-1,3,5-triazine;ethane (PubChem CID 91071262) has the molecular formula C11H11Cl2N3O and a molecular weight of 272.14 g/mol. Its IUPAC name is 2,4-dichloro-6-phenoxy-1,3,5-triazine;ethane.

Molecular Properties

Compound Name2,4-dichloro-6-phenoxy-1,3,5-triazine;ethane
PubChem CID91071262
Molecular FormulaC11H11Cl2N3O
Molecular Weight272.14 g/mol
Exact Mass271.03
IUPAC Name2,4-dichloro-6-phenoxy-1,3,5-triazine;ethane
SMILESCC.Clc1nc(Cl)nc(Oc2ccccc2)n1
InChIInChI=1S/C9H5Cl2N3O.C2H6/c10-7-12-8(11)14-9(13-7)15-6-4-2-1-3-5-6;1-2/h1-5H;1-2H3
InChIKeyRBJUFMGJGKVKQI-UHFFFAOYSA-N
XLogP4.00
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.14
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2,4-dichloro-6-[4-[(4,6-dichloro-1,3,5-triazin-2-yl)oxy]phenoxy]-1,3,5-triazine
CID 10341266
2,4-bis(4-benzylphenoxy)-6-chloro-1,3,5-triazine
CID 21413010
2-(4-bromophenoxy)-4,6-dichloro-1,3,5-triazine
CID 3858351
2-(3-tert-butylphenoxy)-4,6-dichloro-1,3,5-triazine
CID 55124372
4-chloro-6-(4-phenylphenoxy)-1,3,5-triazin-2-amine
CID 80867587
4-[(4,6-dichloro-1,3,5-triazin-2-yl)oxy]benzonitrile
CID 58974961
2,4-dichloro-6-(2-methoxyphenoxy)-1,3,5-triazine
CID 54201901
2,4-dichloro-6-(3,5-dimethoxyphenoxy)-1,3,5-triazine
CID 62858062
2,4-dichloro-6-[4-(4-phenylmethoxyphenyl)sulfanylphenoxy]-1,3,5-triazine
CID 54075621
2-phenoxy-4,6-bis(sulfanyloxy)-1,3,5-triazine
CID 145326243
2,4-dichloro-6-(2-ethoxyphenoxy)-1,3,5-triazine
CID 62858074
4-[(4,6-diphenoxy-1,3,5-triazin-2-yl)oxy]benzonitrile
CID 162501099

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-6-phenoxy-1,3,5-triazine;ethane?
The IUPAC name of 2,4-dichloro-6-phenoxy-1,3,5-triazine;ethane (CID 91071262) is 2,4-dichloro-6-phenoxy-1,3,5-triazine;ethane.
What is the SMILES notation for 2,4-dichloro-6-phenoxy-1,3,5-triazine;ethane?
The canonical SMILES for 2,4-dichloro-6-phenoxy-1,3,5-triazine;ethane is CC.Clc1nc(Cl)nc(Oc2ccccc2)n1.
What is the InChIKey of 2,4-dichloro-6-phenoxy-1,3,5-triazine;ethane?
The InChIKey is RBJUFMGJGKVKQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5Cl2N3O.C2H6/c10-7-12-8(11)14-9(13-7)15-6-4-2-1-3-5-6;1-2/h1-5H;1-2H3.
What are the key properties of 2,4-dichloro-6-phenoxy-1,3,5-triazine;ethane?
2,4-dichloro-6-phenoxy-1,3,5-triazine;ethane has a molecular weight of 272.14 g/mol, XLogP of 4.00, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-6-phenoxy-1,3,5-triazine;ethane is sourced from PubChem (CID 91071262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).