4-chloro-2-[(2-chlorophenyl)methyl]-1-methylbenzene

C14H12Cl2 — CID 90782927

IUPAC4-chloro-2-[(2-chlorophenyl)methyl]-1-methylbenzene
SMILESCc1ccc(Cl)cc1Cc1ccccc1Cl
InChIInChI=1S/C14H12Cl2/c1-10-6-7-13(15)9-12(10)8-11-4-2-3-5-14(11)16/h2-7,9H,8H2,1H3
InChIKeyPFIKYNKRQQTBRO-UHFFFAOYSA-N
MW251.16 g/mol
LogP4.89
Rot. Bonds2

About 4-chloro-2-[(2-chlorophenyl)methyl]-1-methylbenzene

4-chloro-2-[(2-chlorophenyl)methyl]-1-methylbenzene (PubChem CID 90782927) has the molecular formula C14H12Cl2 and a molecular weight of 251.16 g/mol. Its IUPAC name is 4-chloro-2-[(2-chlorophenyl)methyl]-1-methylbenzene.

Molecular Properties

Compound Name4-chloro-2-[(2-chlorophenyl)methyl]-1-methylbenzene
PubChem CID90782927
Molecular FormulaC14H12Cl2
Molecular Weight251.16 g/mol
Exact Mass250.03
IUPAC Name4-chloro-2-[(2-chlorophenyl)methyl]-1-methylbenzene
SMILESCc1ccc(Cl)cc1Cc1ccccc1Cl
InChIInChI=1S/C14H12Cl2/c1-10-6-7-13(15)9-12(10)8-11-4-2-3-5-14(11)16/h2-7,9H,8H2,1H3
InChIKeyPFIKYNKRQQTBRO-UHFFFAOYSA-N
XLogP4.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.16
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 4-chloro-2-[(2-chlorophenyl)methyl]-1-methylbenzene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,2-dichloro-4-[(2,5-dichlorophenyl)methyl]-5-methylbenzene
CID 14252297
4-chloro-2-[(2-methylphenyl)methyl]aniline
CID 105490375
1-[(2-chlorophenyl)methyl]-2-fluoro-3-methylbenzene
CID 130411639
1-chloro-3-[(2,5-dimethylphenyl)methyl]-2-methylbenzene
CID 22768598
5-chloro-N-[3-(2-chlorophenyl)propyl]-2-methylaniline
CID 54798681
2,4-dichloro-1-[(2,4-dimethylphenyl)methyl]benzene
CID 57116365
4-chloro-2-(2,2-dimethylpropyl)-1-methylbenzene
CID 20782922
4-[(2-chlorophenyl)methyl]-5-methylthiophen-2-amine
CID 98771509
1-(4-chloro-2-methylphenyl)-N-[(2-methylphenyl)methyl]methanamine
CID 104853852
4-chloro-1-methyl-2-(nitrosomethyl)benzene
CID 142051327
4-chloro-2-(3-chloropropyl)-1-methylbenzene
CID 118805729
2-[4-chloro-N-(4-chloro-2,5-dimethylphenyl)sulfonyl-2-[(2-chlorophenyl)methyl]anilino]acetamide
CID 58941467

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-[(2-chlorophenyl)methyl]-1-methylbenzene?
The IUPAC name of 4-chloro-2-[(2-chlorophenyl)methyl]-1-methylbenzene (CID 90782927) is 4-chloro-2-[(2-chlorophenyl)methyl]-1-methylbenzene.
What is the SMILES notation for 4-chloro-2-[(2-chlorophenyl)methyl]-1-methylbenzene?
The canonical SMILES for 4-chloro-2-[(2-chlorophenyl)methyl]-1-methylbenzene is Cc1ccc(Cl)cc1Cc1ccccc1Cl.
What is the InChIKey of 4-chloro-2-[(2-chlorophenyl)methyl]-1-methylbenzene?
The InChIKey is PFIKYNKRQQTBRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2/c1-10-6-7-13(15)9-12(10)8-11-4-2-3-5-14(11)16/h2-7,9H,8H2,1H3.
What are the key properties of 4-chloro-2-[(2-chlorophenyl)methyl]-1-methylbenzene?
4-chloro-2-[(2-chlorophenyl)methyl]-1-methylbenzene has a molecular weight of 251.16 g/mol, XLogP of 4.89, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-[(2-chlorophenyl)methyl]-1-methylbenzene is sourced from PubChem (CID 90782927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).