4-Methoxydiphenylmethane

C14H14O — CID 13264

IUPAC1-benzyl-4-methoxybenzene
SMILESCOC1=CC=C(C=C1)CC2=CC=CC=C2
InChIInChI=1S/C14H14O/c1-15-14-9-7-13(8-10-14)11-12-5-3-2-4-6-12/h2-10H,11H2,1H3
InChIKeyGQLYCRTUQGSDSM-UHFFFAOYSA-N
MW198.26 g/mol
LogP3.80
Rot. Bonds3

About 4-Methoxydiphenylmethane

4-Methoxydiphenylmethane (PubChem CID 13264) has the molecular formula C14H14O and a molecular weight of 198.26 g/mol. Its IUPAC name is 1-benzyl-4-methoxybenzene.

Molecular Properties

Compound Name4-Methoxydiphenylmethane
PubChem CID13264
Molecular FormulaC14H14O
Molecular Weight198.26 g/mol
Exact Mass198.10
IUPAC Name1-benzyl-4-methoxybenzene
SMILESCOC1=CC=C(C=C1)CC2=CC=CC=C2
InChIInChI=1S/C14H14O/c1-15-14-9-7-13(8-10-14)11-12-5-3-2-4-6-12/h2-10H,11H2,1H3
InChIKeyGQLYCRTUQGSDSM-UHFFFAOYSA-N
XLogP3.80
TPSA9.20 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity164

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.26
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-Methoxydiphenylmethane?
The IUPAC name of 4-Methoxydiphenylmethane (CID 13264) is 1-benzyl-4-methoxybenzene.
What is the SMILES notation for 4-Methoxydiphenylmethane?
The canonical SMILES for 4-Methoxydiphenylmethane is COC1=CC=C(C=C1)CC2=CC=CC=C2.
What is the InChIKey of 4-Methoxydiphenylmethane?
The InChIKey is GQLYCRTUQGSDSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14O/c1-15-14-9-7-13(8-10-14)11-12-5-3-2-4-6-12/h2-10H,11H2,1H3.
What are the key properties of 4-Methoxydiphenylmethane?
4-Methoxydiphenylmethane has a molecular weight of 198.26 g/mol, XLogP of 3.80, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-Methoxydiphenylmethane is sourced from PubChem (CID 13264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).