4-(4-chlorophenyl)-2-ethyl-1-methylbenzene

C15H15Cl — CID 22968913

IUPAC4-(4-chlorophenyl)-2-ethyl-1-methylbenzene
SMILESCCc1cc(-c2ccc(Cl)cc2)ccc1C
InChIInChI=1S/C15H15Cl/c1-3-12-10-14(5-4-11(12)2)13-6-8-15(16)9-7-13/h4-10H,3H2,1-2H3
InChIKeyPAXJDZPNNWWSEA-UHFFFAOYSA-N
MW230.74 g/mol
LogP4.88
Rot. Bonds2

About 4-(4-chlorophenyl)-2-ethyl-1-methylbenzene

4-(4-chlorophenyl)-2-ethyl-1-methylbenzene (PubChem CID 22968913) has the molecular formula C15H15Cl and a molecular weight of 230.74 g/mol. Its IUPAC name is 4-(4-chlorophenyl)-2-ethyl-1-methylbenzene.

Molecular Properties

Compound Name4-(4-chlorophenyl)-2-ethyl-1-methylbenzene
PubChem CID22968913
Molecular FormulaC15H15Cl
Molecular Weight230.74 g/mol
Exact Mass230.09
IUPAC Name4-(4-chlorophenyl)-2-ethyl-1-methylbenzene
SMILESCCc1cc(-c2ccc(Cl)cc2)ccc1C
InChIInChI=1S/C15H15Cl/c1-3-12-10-14(5-4-11(12)2)13-6-8-15(16)9-7-13/h4-10H,3H2,1-2H3
InChIKeyPAXJDZPNNWWSEA-UHFFFAOYSA-N
XLogP4.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.74
LogP ≤ 54.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-ethyl-1-methyl-4-(4-methylphenyl)benzene
CID 59090118
4-(3,4-dimethylphenyl)-2-ethyl-1-methylbenzene
CID 123136977
2-ethyl-1-methyl-4-(4-propylphenyl)benzene
CID 123879424
4-(4-chlorophenyl)-1-ethyl-2-(methylsulfinylmethyl)benzene
CID 143050843
5-(4-chlorophenyl)-3-ethylpyridin-2-amine
CID 142402687
methyl 6-[5-(4-chlorophenyl)-2-methylphenyl]-2,2-dimethyl-5-oxohexanoate
CID 23390563
ethyl 2-[5-(4-chlorophenyl)-2-ethylphenyl]-2-oxoacetate
CID 66691355
4-(4-chloro-2-methylphenyl)-2-ethylaniline
CID 172652422
[5-(3-chlorophenyl)-2-methylphenyl]methanamine
CID 115038622
2-ethyl-4-(2-iodophenyl)-1-methylbenzene
CID 142879515
[2-methyl-5-(4-methylphenyl)phenyl]methanamine
CID 115027522
4-(3,4-dimethylphenyl)-2-ethylaniline
CID 81287148

Frequently Asked Questions

What is the IUPAC name of 4-(4-chlorophenyl)-2-ethyl-1-methylbenzene?
The IUPAC name of 4-(4-chlorophenyl)-2-ethyl-1-methylbenzene (CID 22968913) is 4-(4-chlorophenyl)-2-ethyl-1-methylbenzene.
What is the SMILES notation for 4-(4-chlorophenyl)-2-ethyl-1-methylbenzene?
The canonical SMILES for 4-(4-chlorophenyl)-2-ethyl-1-methylbenzene is CCc1cc(-c2ccc(Cl)cc2)ccc1C.
What is the InChIKey of 4-(4-chlorophenyl)-2-ethyl-1-methylbenzene?
The InChIKey is PAXJDZPNNWWSEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15Cl/c1-3-12-10-14(5-4-11(12)2)13-6-8-15(16)9-7-13/h4-10H,3H2,1-2H3.
What are the key properties of 4-(4-chlorophenyl)-2-ethyl-1-methylbenzene?
4-(4-chlorophenyl)-2-ethyl-1-methylbenzene has a molecular weight of 230.74 g/mol, XLogP of 4.88, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chlorophenyl)-2-ethyl-1-methylbenzene is sourced from PubChem (CID 22968913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).