2-(2,6-dichlorophenyl)ethylazanium

C8H10Cl2N+ — CID 6951285

IUPAC2-(2,6-dichlorophenyl)ethylazanium
SMILES[NH3+]CCc1c(Cl)cccc1Cl
InChIInChI=1S/C8H9Cl2N/c9-7-2-1-3-8(10)6(7)4-5-11/h1-3H,4-5,11H2/p+1
InChIKeyACIMQXSSGMWVKG-UHFFFAOYSA-O
MW191.08 g/mol
LogP1.78
Rot. Bonds2

About 2-(2,6-dichlorophenyl)ethylazanium

2-(2,6-dichlorophenyl)ethylazanium (PubChem CID 6951285) has the molecular formula C8H10Cl2N+ and a molecular weight of 191.08 g/mol. Its IUPAC name is 2-(2,6-dichlorophenyl)ethylazanium.

Molecular Properties

Compound Name2-(2,6-dichlorophenyl)ethylazanium
PubChem CID6951285
Molecular FormulaC8H10Cl2N+
Molecular Weight191.08 g/mol
Exact Mass190.02
IUPAC Name2-(2,6-dichlorophenyl)ethylazanium
SMILES[NH3+]CCc1c(Cl)cccc1Cl
InChIInChI=1S/C8H9Cl2N/c9-7-2-1-3-8(10)6(7)4-5-11/h1-3H,4-5,11H2/p+1
InChIKeyACIMQXSSGMWVKG-UHFFFAOYSA-O
XLogP1.78
TPSA27.64 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.08
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

3-(2,6-dichlorophenyl)propane-1-thiol
CID 83924894
6-(2,6-dichlorophenyl)hexane-1-thiol
CID 10777932
1-(2,6-dichlorophenyl)-N-methylmethanamine;ethane
CID 142839804
1,3-dichloro-2-[(2,6-dichlorophenyl)methylselanylmethyl]benzene
CID 139083206
(1E)-3-(2,6-dichlorophenyl)-N-hydroxypropanimidoyl chloride
CID 59264862
N-[(2,6-dichlorophenyl)methyl]ethanamine;hydrochloride
CID 17290765
(2,6-dichlorophenyl)methyl thiohypochlorite
CID 141002030
1,3-dichloro-2-(4-chlorohexyl)benzene
CID 64506411
2-(4-bromopentyl)-1,3-dichlorobenzene
CID 64509594
2-[2-(2,6-dichlorophenyl)ethyl]guanidine;hydroiodide
CID 51131579
(2,6-dichlorophenyl)methylcarbamic acid
CID 77230594
3-chloro-2-propylphenol
CID 15747295

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dichlorophenyl)ethylazanium?
The IUPAC name of 2-(2,6-dichlorophenyl)ethylazanium (CID 6951285) is 2-(2,6-dichlorophenyl)ethylazanium.
What is the SMILES notation for 2-(2,6-dichlorophenyl)ethylazanium?
The canonical SMILES for 2-(2,6-dichlorophenyl)ethylazanium is [NH3+]CCc1c(Cl)cccc1Cl.
What is the InChIKey of 2-(2,6-dichlorophenyl)ethylazanium?
The InChIKey is ACIMQXSSGMWVKG-UHFFFAOYSA-O. The full InChI is InChI=1S/C8H9Cl2N/c9-7-2-1-3-8(10)6(7)4-5-11/h1-3H,4-5,11H2/p+1.
What are the key properties of 2-(2,6-dichlorophenyl)ethylazanium?
2-(2,6-dichlorophenyl)ethylazanium has a molecular weight of 191.08 g/mol, XLogP of 1.78, 2 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dichlorophenyl)ethylazanium is sourced from PubChem (CID 6951285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).