2-methoxy-1,3-diphenylbenzene

C19H16O — CID 23524590

IUPAC2-methoxy-1,3-diphenylbenzene
SMILESCOc1c(-c2ccccc2)cccc1-c1ccccc1
InChIInChI=1S/C19H16O/c1-20-19-17(15-9-4-2-5-10-15)13-8-14-18(19)16-11-6-3-7-12-16/h2-14H,1H3
InChIKeyGZPSSLBABVRXFT-UHFFFAOYSA-N
MW260.34 g/mol
LogP5.03
Rot. Bonds3

About 2-methoxy-1,3-diphenylbenzene

2-methoxy-1,3-diphenylbenzene (PubChem CID 23524590) has the molecular formula C19H16O and a molecular weight of 260.34 g/mol. Its IUPAC name is 2-methoxy-1,3-diphenylbenzene.

Molecular Properties

Compound Name2-methoxy-1,3-diphenylbenzene
PubChem CID23524590
Molecular FormulaC19H16O
Molecular Weight260.34 g/mol
Exact Mass260.12
IUPAC Name2-methoxy-1,3-diphenylbenzene
SMILESCOc1c(-c2ccccc2)cccc1-c1ccccc1
InChIInChI=1S/C19H16O/c1-20-19-17(15-9-4-2-5-10-15)13-8-14-18(19)16-11-6-3-7-12-16/h2-14H,1H3
InChIKeyGZPSSLBABVRXFT-UHFFFAOYSA-N
XLogP5.03
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500260.34
LogP ≤ 55.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-iodo-2-methoxy-3-phenylbenzene
CID 164896113
2-(2-methoxy-3-phenylphenyl)-1-methylpyridin-1-ium
CID 170543584
2-methoxy-3-phenylbenzonitrile
CID 91276072
(2-methoxy-3-phenylphenyl)-phenyldiazene
CID 21342365
O-(2,6-diphenylphenyl)hydroxylamine
CID 146317858
1,2,3-trimethoxy-5-[2-phenyl-6-(3,4,5-trimethoxyphenyl)phenyl]benzene
CID 174734654
1-(4-methylphenyl)-2-[2-(4-methylphenyl)-6-phenylphenoxy]-3-phenylbenzene
CID 140972747
6,7-dimethoxy-1,4-diphenylnaphthalene
CID 134090814
3-(2-methoxy-3-pyridin-3-ylphenyl)pyridine
CID 46316374
(E)-3-(2-methoxy-3-phenylphenyl)prop-2-enoic acid
CID 170872372
2-[1-(2-methoxy-3-phenylphenyl)ethyl]-6-phenylphenol
CID 58238506
(2,6-diphenylphenyl) methyl carbonate
CID 121292231

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1,3-diphenylbenzene?
The IUPAC name of 2-methoxy-1,3-diphenylbenzene (CID 23524590) is 2-methoxy-1,3-diphenylbenzene.
What is the SMILES notation for 2-methoxy-1,3-diphenylbenzene?
The canonical SMILES for 2-methoxy-1,3-diphenylbenzene is COc1c(-c2ccccc2)cccc1-c1ccccc1.
What is the InChIKey of 2-methoxy-1,3-diphenylbenzene?
The InChIKey is GZPSSLBABVRXFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16O/c1-20-19-17(15-9-4-2-5-10-15)13-8-14-18(19)16-11-6-3-7-12-16/h2-14H,1H3.
What are the key properties of 2-methoxy-1,3-diphenylbenzene?
2-methoxy-1,3-diphenylbenzene has a molecular weight of 260.34 g/mol, XLogP of 5.03, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1,3-diphenylbenzene is sourced from PubChem (CID 23524590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).