2-methyl-4-(4-methylphenyl)-1-phenylmethoxybenzene

C21H20O — CID 142190093

IUPAC2-methyl-4-(4-methylphenyl)-1-phenylmethoxybenzene
SMILESCc1ccc(-c2ccc(OCc3ccccc3)c(C)c2)cc1
InChIInChI=1S/C21H20O/c1-16-8-10-19(11-9-16)20-12-13-21(17(2)14-20)22-15-18-6-4-3-5-7-18/h3-14H,15H2,1-2H3
InChIKeyAVCZJNYMOPMDIG-UHFFFAOYSA-N
MW288.39 g/mol
LogP5.55
Rot. Bonds4

About 2-methyl-4-(4-methylphenyl)-1-phenylmethoxybenzene

2-methyl-4-(4-methylphenyl)-1-phenylmethoxybenzene (PubChem CID 142190093) has the molecular formula C21H20O and a molecular weight of 288.39 g/mol. Its IUPAC name is 2-methyl-4-(4-methylphenyl)-1-phenylmethoxybenzene.

Molecular Properties

Compound Name2-methyl-4-(4-methylphenyl)-1-phenylmethoxybenzene
PubChem CID142190093
Molecular FormulaC21H20O
Molecular Weight288.39 g/mol
Exact Mass288.15
IUPAC Name2-methyl-4-(4-methylphenyl)-1-phenylmethoxybenzene
SMILESCc1ccc(-c2ccc(OCc3ccccc3)c(C)c2)cc1
InChIInChI=1S/C21H20O/c1-16-8-10-19(11-9-16)20-12-13-21(17(2)14-20)22-15-18-6-4-3-5-7-18/h3-14H,15H2,1-2H3
InChIKeyAVCZJNYMOPMDIG-UHFFFAOYSA-N
XLogP5.55
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500288.39
LogP ≤ 55.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-methoxy-4-(3-methyl-4-phenylmethoxyphenyl)phenol
CID 145389555
1-ethoxy-2-methyl-4-(4-methylphenyl)benzene
CID 59737736
1,2-dimethyl-5-phenyl-3-phenylmethoxybenzene
CID 175309090
1-(isothiocyanatomethoxy)-2-methyl-4-phenylbenzene
CID 21388084
5-phenyl-2-phenylmethoxyphenol
CID 11994792
6-fluoro-2-(3-methyl-4-phenylmethoxyphenyl)imidazo[1,2-a]pyridine
CID 58191816
3-methyl-4-phenylmethoxybenzoic acid
CID 53471145
azane;4-methoxy-2-methyl-1-phenylmethoxybenzene;hydrochloride
CID 174629169
2-(3-methyl-4-phenylmethoxyphenyl)acetamide
CID 67539296
methanol;2-phenylmethoxybicyclo[3.1.0]hexa-1,3,5-triene
CID 174530188
1-[4-(methoxymethoxy)phenyl]-4-(4-methylphenyl)-2-phenylmethoxybenzene
CID 118944139
1-bromo-6-methyl-7-(4-methylphenyl)-4-phenylmethoxynaphthalene
CID 121324732

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-(4-methylphenyl)-1-phenylmethoxybenzene?
The IUPAC name of 2-methyl-4-(4-methylphenyl)-1-phenylmethoxybenzene (CID 142190093) is 2-methyl-4-(4-methylphenyl)-1-phenylmethoxybenzene.
What is the SMILES notation for 2-methyl-4-(4-methylphenyl)-1-phenylmethoxybenzene?
The canonical SMILES for 2-methyl-4-(4-methylphenyl)-1-phenylmethoxybenzene is Cc1ccc(-c2ccc(OCc3ccccc3)c(C)c2)cc1.
What is the InChIKey of 2-methyl-4-(4-methylphenyl)-1-phenylmethoxybenzene?
The InChIKey is AVCZJNYMOPMDIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20O/c1-16-8-10-19(11-9-16)20-12-13-21(17(2)14-20)22-15-18-6-4-3-5-7-18/h3-14H,15H2,1-2H3.
What are the key properties of 2-methyl-4-(4-methylphenyl)-1-phenylmethoxybenzene?
2-methyl-4-(4-methylphenyl)-1-phenylmethoxybenzene has a molecular weight of 288.39 g/mol, XLogP of 5.55, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-(4-methylphenyl)-1-phenylmethoxybenzene is sourced from PubChem (CID 142190093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).