4-chloro-2-[(5-chloro-2-methoxyphenyl)methyl]-1-methoxybenzene

C15H14Cl2O2 — CID 626547

IUPAC4-chloro-2-[(5-chloro-2-methoxyphenyl)methyl]-1-methoxybenzene
SMILESCOc1ccc(Cl)cc1Cc1cc(Cl)ccc1OC
InChIInChI=1S/C15H14Cl2O2/c1-18-14-5-3-12(16)8-10(14)7-11-9-13(17)4-6-15(11)19-2/h3-6,8-9H,7H2,1-2H3
InChIKeyVKUIFKTUHLDCRV-UHFFFAOYSA-N
MW297.18 g/mol
LogP4.60
Rot. Bonds4

About 4-chloro-2-[(5-chloro-2-methoxyphenyl)methyl]-1-methoxybenzene

4-chloro-2-[(5-chloro-2-methoxyphenyl)methyl]-1-methoxybenzene (PubChem CID 626547) has the molecular formula C15H14Cl2O2 and a molecular weight of 297.18 g/mol. Its IUPAC name is 4-chloro-2-[(5-chloro-2-methoxyphenyl)methyl]-1-methoxybenzene.

Molecular Properties

Compound Name4-chloro-2-[(5-chloro-2-methoxyphenyl)methyl]-1-methoxybenzene
PubChem CID626547
Molecular FormulaC15H14Cl2O2
Molecular Weight297.18 g/mol
Exact Mass296.04
IUPAC Name4-chloro-2-[(5-chloro-2-methoxyphenyl)methyl]-1-methoxybenzene
SMILESCOc1ccc(Cl)cc1Cc1cc(Cl)ccc1OC
InChIInChI=1S/C15H14Cl2O2/c1-18-14-5-3-12(16)8-10(14)7-11-9-13(17)4-6-15(11)19-2/h3-6,8-9H,7H2,1-2H3
InChIKeyVKUIFKTUHLDCRV-UHFFFAOYSA-N
XLogP4.60
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.18
LogP ≤ 54.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-chloro-2-(fluoromethyl)-1-methoxybenzene
CID 142810663
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N-[(5-chloro-2-methoxyphenyl)methyl]-N-methylpropan-2-amine
CID 78821316
N-[(5-chloro-2-methoxyphenyl)methyl]-1-(4-chlorophenyl)methanamine
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CID 62602017
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Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-[(5-chloro-2-methoxyphenyl)methyl]-1-methoxybenzene?
The IUPAC name of 4-chloro-2-[(5-chloro-2-methoxyphenyl)methyl]-1-methoxybenzene (CID 626547) is 4-chloro-2-[(5-chloro-2-methoxyphenyl)methyl]-1-methoxybenzene.
What is the SMILES notation for 4-chloro-2-[(5-chloro-2-methoxyphenyl)methyl]-1-methoxybenzene?
The canonical SMILES for 4-chloro-2-[(5-chloro-2-methoxyphenyl)methyl]-1-methoxybenzene is COc1ccc(Cl)cc1Cc1cc(Cl)ccc1OC.
What is the InChIKey of 4-chloro-2-[(5-chloro-2-methoxyphenyl)methyl]-1-methoxybenzene?
The InChIKey is VKUIFKTUHLDCRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2O2/c1-18-14-5-3-12(16)8-10(14)7-11-9-13(17)4-6-15(11)19-2/h3-6,8-9H,7H2,1-2H3.
What are the key properties of 4-chloro-2-[(5-chloro-2-methoxyphenyl)methyl]-1-methoxybenzene?
4-chloro-2-[(5-chloro-2-methoxyphenyl)methyl]-1-methoxybenzene has a molecular weight of 297.18 g/mol, XLogP of 4.60, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-[(5-chloro-2-methoxyphenyl)methyl]-1-methoxybenzene is sourced from PubChem (CID 626547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).