2-[(4-methylphenyl)-phenylmethoxy]oxane

C19H22O2 — CID 134956694

IUPAC2-[(4-methylphenyl)-phenylmethoxy]oxane
SMILESCc1ccc(C(OC2CCCCO2)c2ccccc2)cc1
InChIInChI=1S/C19H22O2/c1-15-10-12-17(13-11-15)19(16-7-3-2-4-8-16)21-18-9-5-6-14-20-18/h2-4,7-8,10-13,18-19H,5-6,9,14H2,1H3
InChIKeyVNFIUVZEZOGHJY-UHFFFAOYSA-N
MW282.38 g/mol
LogP4.63
Rot. Bonds4

About 2-[(4-methylphenyl)-phenylmethoxy]oxane

2-[(4-methylphenyl)-phenylmethoxy]oxane (PubChem CID 134956694) has the molecular formula C19H22O2 and a molecular weight of 282.38 g/mol. Its IUPAC name is 2-[(4-methylphenyl)-phenylmethoxy]oxane.

Molecular Properties

Compound Name2-[(4-methylphenyl)-phenylmethoxy]oxane
PubChem CID134956694
Molecular FormulaC19H22O2
Molecular Weight282.38 g/mol
Exact Mass282.16
IUPAC Name2-[(4-methylphenyl)-phenylmethoxy]oxane
SMILESCc1ccc(C(OC2CCCCO2)c2ccccc2)cc1
InChIInChI=1S/C19H22O2/c1-15-10-12-17(13-11-15)19(16-7-3-2-4-8-16)21-18-9-5-6-14-20-18/h2-4,7-8,10-13,18-19H,5-6,9,14H2,1H3
InChIKeyVNFIUVZEZOGHJY-UHFFFAOYSA-N
XLogP4.63
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 54.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-methylphenyl)-phenylmethoxy]oxane?
The IUPAC name of 2-[(4-methylphenyl)-phenylmethoxy]oxane (CID 134956694) is 2-[(4-methylphenyl)-phenylmethoxy]oxane.
What is the SMILES notation for 2-[(4-methylphenyl)-phenylmethoxy]oxane?
The canonical SMILES for 2-[(4-methylphenyl)-phenylmethoxy]oxane is Cc1ccc(C(OC2CCCCO2)c2ccccc2)cc1.
What is the InChIKey of 2-[(4-methylphenyl)-phenylmethoxy]oxane?
The InChIKey is VNFIUVZEZOGHJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22O2/c1-15-10-12-17(13-11-15)19(16-7-3-2-4-8-16)21-18-9-5-6-14-20-18/h2-4,7-8,10-13,18-19H,5-6,9,14H2,1H3.
What are the key properties of 2-[(4-methylphenyl)-phenylmethoxy]oxane?
2-[(4-methylphenyl)-phenylmethoxy]oxane has a molecular weight of 282.38 g/mol, XLogP of 4.63, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methylphenyl)-phenylmethoxy]oxane is sourced from PubChem (CID 134956694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).