2,3-dichloro-1-[(2,3-dichlorophenyl)methyl]-4-methylbenzene

C14H10Cl4 — CID 14252253

IUPAC2,3-dichloro-1-[(2,3-dichlorophenyl)methyl]-4-methylbenzene
SMILESCc1ccc(Cc2cccc(Cl)c2Cl)c(Cl)c1Cl
InChIInChI=1S/C14H10Cl4/c1-8-5-6-10(14(18)12(8)16)7-9-3-2-4-11(15)13(9)17/h2-6H,7H2,1H3
InChIKeySZXCYPMZATWLJP-UHFFFAOYSA-N
MW320.05 g/mol
LogP6.20
Rot. Bonds2

About 2,3-dichloro-1-[(2,3-dichlorophenyl)methyl]-4-methylbenzene

2,3-dichloro-1-[(2,3-dichlorophenyl)methyl]-4-methylbenzene (PubChem CID 14252253) has the molecular formula C14H10Cl4 and a molecular weight of 320.05 g/mol. Its IUPAC name is 2,3-dichloro-1-[(2,3-dichlorophenyl)methyl]-4-methylbenzene.

Molecular Properties

Compound Name2,3-dichloro-1-[(2,3-dichlorophenyl)methyl]-4-methylbenzene
PubChem CID14252253
Molecular FormulaC14H10Cl4
Molecular Weight320.05 g/mol
Exact Mass317.95
IUPAC Name2,3-dichloro-1-[(2,3-dichlorophenyl)methyl]-4-methylbenzene
SMILESCc1ccc(Cc2cccc(Cl)c2Cl)c(Cl)c1Cl
InChIInChI=1S/C14H10Cl4/c1-8-5-6-10(14(18)12(8)16)7-9-3-2-4-11(15)13(9)17/h2-6H,7H2,1H3
InChIKeySZXCYPMZATWLJP-UHFFFAOYSA-N
XLogP6.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.05
LogP ≤ 56.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-(2,3-dichloro-4-methylphenyl)acetic acid
CID 119014032
1-(4-bromo-3,5-dimethylphenyl)-2-(2,3-dichlorophenyl)-N-methylethanamine
CID 107309145
6-[(2,3-dichlorophenyl)methyl]-1,3,5-triazine-2,4-diamine
CID 91872292
2-(2,3-dichlorophenyl)-N-methyl-1-(2,4,6-trimethylphenyl)ethanamine
CID 107312240
1-(5-bromo-2-methylphenyl)-2-(2,3-dichlorophenyl)-N-methylethanamine
CID 107312321
1,2-dichloro-3-(iodomethyl)benzene
CID 107310418
(2,3-dichlorophenyl)methylazanium
CID 6951258
4-(2,3-dichlorophenyl)-N-methylbutan-2-amine
CID 64503767
1-chloro-3-[(2,5-dimethylphenyl)methyl]-2-methylbenzene
CID 22768598
(2,3-dichlorophenyl)methyl-methylazanium
CID 2060843
1-[(2-chlorophenyl)methyl]-2-fluoro-3-methylbenzene
CID 130411639
2-chloro-N-[(2-chlorophenyl)methyl]-3-methylaniline
CID 114251746

Frequently Asked Questions

What is the IUPAC name of 2,3-dichloro-1-[(2,3-dichlorophenyl)methyl]-4-methylbenzene?
The IUPAC name of 2,3-dichloro-1-[(2,3-dichlorophenyl)methyl]-4-methylbenzene (CID 14252253) is 2,3-dichloro-1-[(2,3-dichlorophenyl)methyl]-4-methylbenzene.
What is the SMILES notation for 2,3-dichloro-1-[(2,3-dichlorophenyl)methyl]-4-methylbenzene?
The canonical SMILES for 2,3-dichloro-1-[(2,3-dichlorophenyl)methyl]-4-methylbenzene is Cc1ccc(Cc2cccc(Cl)c2Cl)c(Cl)c1Cl.
What is the InChIKey of 2,3-dichloro-1-[(2,3-dichlorophenyl)methyl]-4-methylbenzene?
The InChIKey is SZXCYPMZATWLJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl4/c1-8-5-6-10(14(18)12(8)16)7-9-3-2-4-11(15)13(9)17/h2-6H,7H2,1H3.
What are the key properties of 2,3-dichloro-1-[(2,3-dichlorophenyl)methyl]-4-methylbenzene?
2,3-dichloro-1-[(2,3-dichlorophenyl)methyl]-4-methylbenzene has a molecular weight of 320.05 g/mol, XLogP of 6.20, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dichloro-1-[(2,3-dichlorophenyl)methyl]-4-methylbenzene is sourced from PubChem (CID 14252253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).