1-methyl-2-[[2-(phenoxymethyl)phenyl]methoxy]benzene

C21H20O2 — CID 151703929

IUPAC1-methyl-2-[[2-(phenoxymethyl)phenyl]methoxy]benzene
SMILESCc1ccccc1OCc1ccccc1COc1ccccc1
InChIInChI=1S/C21H20O2/c1-17-9-5-8-14-21(17)23-16-19-11-7-6-10-18(19)15-22-20-12-3-2-4-13-20/h2-14H,15-16H2,1H3
InChIKeyRFEHIBAAHMEJKY-UHFFFAOYSA-N
MW304.39 g/mol
LogP5.15
Rot. Bonds6

About 1-methyl-2-[[2-(phenoxymethyl)phenyl]methoxy]benzene

1-methyl-2-[[2-(phenoxymethyl)phenyl]methoxy]benzene (PubChem CID 151703929) has the molecular formula C21H20O2 and a molecular weight of 304.39 g/mol. Its IUPAC name is 1-methyl-2-[[2-(phenoxymethyl)phenyl]methoxy]benzene.

Molecular Properties

Compound Name1-methyl-2-[[2-(phenoxymethyl)phenyl]methoxy]benzene
PubChem CID151703929
Molecular FormulaC21H20O2
Molecular Weight304.39 g/mol
Exact Mass304.15
IUPAC Name1-methyl-2-[[2-(phenoxymethyl)phenyl]methoxy]benzene
SMILESCc1ccccc1OCc1ccccc1COc1ccccc1
InChIInChI=1S/C21H20O2/c1-17-9-5-8-14-21(17)23-16-19-11-7-6-10-18(19)15-22-20-12-3-2-4-13-20/h2-14H,15-16H2,1H3
InChIKeyRFEHIBAAHMEJKY-UHFFFAOYSA-N
XLogP5.15
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500304.39
LogP ≤ 55.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2-methylphenoxy)methyl]aniline
CID 21191823
1,4-dimethyl-2-[(2-methylphenoxy)methyl]benzene
CID 60627928
1-(2-methylpropyl)-2-(phenoxymethyl)benzene
CID 173253706
3-[(2-methylphenoxy)methyl]pyridine-2-carboxylic acid
CID 63073600
2-amino-6-[(2-methylphenoxy)methyl]benzoic acid
CID 104825317
3-[2-[(2-methylphenoxy)methyl]phenyl]prop-2-enoic acid
CID 76908599
1-fluoro-2-[(2-methylphenyl)methoxy]benzene
CID 60627765
methyl 2-[(2-methylphenoxy)methyl]benzoate
CID 11043352
1-methoxy-3-[(2-methylphenoxy)methyl]benzene
CID 59416569
2-[2-(phenoxymethyl)phenyl]ethanamine
CID 113314861
[2-(phenoxymethyl)phenyl]methyl methanesulfonate
CID 126722935
1-methyl-2-[(3-methylphenoxy)methyl]benzene
CID 60627935

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-[[2-(phenoxymethyl)phenyl]methoxy]benzene?
The IUPAC name of 1-methyl-2-[[2-(phenoxymethyl)phenyl]methoxy]benzene (CID 151703929) is 1-methyl-2-[[2-(phenoxymethyl)phenyl]methoxy]benzene.
What is the SMILES notation for 1-methyl-2-[[2-(phenoxymethyl)phenyl]methoxy]benzene?
The canonical SMILES for 1-methyl-2-[[2-(phenoxymethyl)phenyl]methoxy]benzene is Cc1ccccc1OCc1ccccc1COc1ccccc1.
What is the InChIKey of 1-methyl-2-[[2-(phenoxymethyl)phenyl]methoxy]benzene?
The InChIKey is RFEHIBAAHMEJKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20O2/c1-17-9-5-8-14-21(17)23-16-19-11-7-6-10-18(19)15-22-20-12-3-2-4-13-20/h2-14H,15-16H2,1H3.
What are the key properties of 1-methyl-2-[[2-(phenoxymethyl)phenyl]methoxy]benzene?
1-methyl-2-[[2-(phenoxymethyl)phenyl]methoxy]benzene has a molecular weight of 304.39 g/mol, XLogP of 5.15, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-[[2-(phenoxymethyl)phenyl]methoxy]benzene is sourced from PubChem (CID 151703929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).