4-ethenyl-2-(3-methylphenyl)-1-phenylmethoxybenzene

C22H20O — CID 172879772

IUPAC4-ethenyl-2-(3-methylphenyl)-1-phenylmethoxybenzene
SMILESC=Cc1ccc(OCc2ccccc2)c(-c2cccc(C)c2)c1
InChIInChI=1S/C22H20O/c1-3-18-12-13-22(23-16-19-9-5-4-6-10-19)21(15-18)20-11-7-8-17(2)14-20/h3-15H,1,16H2,2H3
InChIKeyDWCSVGWQIVPYRB-UHFFFAOYSA-N
MW300.40 g/mol
LogP5.88
Rot. Bonds5

About 4-ethenyl-2-(3-methylphenyl)-1-phenylmethoxybenzene

4-ethenyl-2-(3-methylphenyl)-1-phenylmethoxybenzene (PubChem CID 172879772) has the molecular formula C22H20O and a molecular weight of 300.40 g/mol. Its IUPAC name is 4-ethenyl-2-(3-methylphenyl)-1-phenylmethoxybenzene.

Molecular Properties

Compound Name4-ethenyl-2-(3-methylphenyl)-1-phenylmethoxybenzene
PubChem CID172879772
Molecular FormulaC22H20O
Molecular Weight300.40 g/mol
Exact Mass300.15
IUPAC Name4-ethenyl-2-(3-methylphenyl)-1-phenylmethoxybenzene
SMILESC=Cc1ccc(OCc2ccccc2)c(-c2cccc(C)c2)c1
InChIInChI=1S/C22H20O/c1-3-18-12-13-22(23-16-19-9-5-4-6-10-19)21(15-18)20-11-7-8-17(2)14-20/h3-15H,1,16H2,2H3
InChIKeyDWCSVGWQIVPYRB-UHFFFAOYSA-N
XLogP5.88
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500300.40
LogP ≤ 55.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-ethenyl-2-(4-phenylmethoxyphenyl)-1-(trifluoromethoxy)benzene
CID 172879654
methanol;2-phenylmethoxybicyclo[3.1.0]hexa-1,3,5-triene
CID 174530188
ethanamine;2-phenylmethoxybicyclo[3.1.0]hexa-1,3,5-triene
CID 174428998
4-ethenyl-1-phenylmethoxy-2-(trifluoromethoxy)benzene
CID 155293536
4-methoxy-3-(3-phenylmethoxyphenyl)benzaldehyde
CID 172879583
4-ethenyl-1-[1-[3-[2-(4-ethenyl-2-phenylmethoxyphenyl)propyl]phenyl]propan-2-yl]-2-phenylmethoxybenzene
CID 139603519
(3-phenyl-4-phenylmethoxyphenyl)methanol
CID 164896135
4-phenylmethoxy-3-thiophen-3-ylbenzaldehyde
CID 172650288
2-[(3-methylphenyl)methoxy]-1-phenylnaphthalene
CID 132584959
5-methyl-2-phenylmethoxybenzaldehyde
CID 1247883
1-ethenyl-3-(phenylmethoxymethyl)benzene
CID 10443616
4-(difluoromethoxy)-3-(3-phenylmethoxyphenyl)benzaldehyde
CID 166639003

Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-2-(3-methylphenyl)-1-phenylmethoxybenzene?
The IUPAC name of 4-ethenyl-2-(3-methylphenyl)-1-phenylmethoxybenzene (CID 172879772) is 4-ethenyl-2-(3-methylphenyl)-1-phenylmethoxybenzene.
What is the SMILES notation for 4-ethenyl-2-(3-methylphenyl)-1-phenylmethoxybenzene?
The canonical SMILES for 4-ethenyl-2-(3-methylphenyl)-1-phenylmethoxybenzene is C=Cc1ccc(OCc2ccccc2)c(-c2cccc(C)c2)c1.
What is the InChIKey of 4-ethenyl-2-(3-methylphenyl)-1-phenylmethoxybenzene?
The InChIKey is DWCSVGWQIVPYRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20O/c1-3-18-12-13-22(23-16-19-9-5-4-6-10-19)21(15-18)20-11-7-8-17(2)14-20/h3-15H,1,16H2,2H3.
What are the key properties of 4-ethenyl-2-(3-methylphenyl)-1-phenylmethoxybenzene?
4-ethenyl-2-(3-methylphenyl)-1-phenylmethoxybenzene has a molecular weight of 300.40 g/mol, XLogP of 5.88, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-2-(3-methylphenyl)-1-phenylmethoxybenzene is sourced from PubChem (CID 172879772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).