[3-methoxy-4-[(2-methylphenyl)methyl]phenyl]methanol

C16H18O2 — CID 22408163

IUPAC[3-methoxy-4-[(2-methylphenyl)methyl]phenyl]methanol
SMILESCOc1cc(CO)ccc1Cc1ccccc1C
InChIInChI=1S/C16H18O2/c1-12-5-3-4-6-14(12)10-15-8-7-13(11-17)9-16(15)18-2/h3-9,17H,10-11H2,1-2H3
InChIKeyHIMVJTXFMDVXPE-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.09
Rot. Bonds4

About [3-methoxy-4-[(2-methylphenyl)methyl]phenyl]methanol

[3-methoxy-4-[(2-methylphenyl)methyl]phenyl]methanol (PubChem CID 22408163) has the molecular formula C16H18O2 and a molecular weight of 242.32 g/mol. Its IUPAC name is [3-methoxy-4-[(2-methylphenyl)methyl]phenyl]methanol.

Molecular Properties

Compound Name[3-methoxy-4-[(2-methylphenyl)methyl]phenyl]methanol
PubChem CID22408163
Molecular FormulaC16H18O2
Molecular Weight242.32 g/mol
Exact Mass242.13
IUPAC Name[3-methoxy-4-[(2-methylphenyl)methyl]phenyl]methanol
SMILESCOc1cc(CO)ccc1Cc1ccccc1C
InChIInChI=1S/C16H18O2/c1-12-5-3-4-6-14(12)10-15-8-7-13(11-17)9-16(15)18-2/h3-9,17H,10-11H2,1-2H3
InChIKeyHIMVJTXFMDVXPE-UHFFFAOYSA-N
XLogP3.09
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(chloromethyl)-2-methoxy-1-[(2-methylphenyl)methyl]benzene
CID 22408155
[4-[(2-methoxyphenyl)methyl]phenyl]methanol
CID 54205335
[4-[(2-methylphenyl)methyl]phenyl]methanol
CID 22408263
[5-(hydroxymethyl)-2-methoxyphenoxy]boronic acid
CID 142791148
2,6-dimethoxy-4-[[(2-methylphenyl)methylamino]methyl]phenol
CID 60657941
[3-[5-(hydroxymethyl)-2-methoxyphenyl]-4-methoxyphenyl]methanol
CID 642903
1,5-dibenzyl-2,4-dimethoxybenzene
CID 134865682
(3-methoxy-4-phosphanyloxyphenyl)methanol
CID 89023367
[3-[(3,4-dimethoxyphenyl)methyl]-2-pyridinyl]methanol
CID 54192940
[2-methoxy-4-[(2-methylphenoxy)methyl]phenyl]methanamine
CID 106786180
4-benzyl-3-methoxyaniline
CID 22599955
[4-(hydroxymethyl)-2-methoxyphenyl] formate
CID 134186869

Frequently Asked Questions

What is the IUPAC name of [3-methoxy-4-[(2-methylphenyl)methyl]phenyl]methanol?
The IUPAC name of [3-methoxy-4-[(2-methylphenyl)methyl]phenyl]methanol (CID 22408163) is [3-methoxy-4-[(2-methylphenyl)methyl]phenyl]methanol.
What is the SMILES notation for [3-methoxy-4-[(2-methylphenyl)methyl]phenyl]methanol?
The canonical SMILES for [3-methoxy-4-[(2-methylphenyl)methyl]phenyl]methanol is COc1cc(CO)ccc1Cc1ccccc1C.
What is the InChIKey of [3-methoxy-4-[(2-methylphenyl)methyl]phenyl]methanol?
The InChIKey is HIMVJTXFMDVXPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O2/c1-12-5-3-4-6-14(12)10-15-8-7-13(11-17)9-16(15)18-2/h3-9,17H,10-11H2,1-2H3.
What are the key properties of [3-methoxy-4-[(2-methylphenyl)methyl]phenyl]methanol?
[3-methoxy-4-[(2-methylphenyl)methyl]phenyl]methanol has a molecular weight of 242.32 g/mol, XLogP of 3.09, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-methoxy-4-[(2-methylphenyl)methyl]phenyl]methanol is sourced from PubChem (CID 22408163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).