1-(methoxymethyl)-4-(4-methoxyphenyl)-2-methylbenzene

C16H18O2 — CID 91108863

IUPAC1-(methoxymethyl)-4-(4-methoxyphenyl)-2-methylbenzene
SMILESCOCc1ccc(-c2ccc(OC)cc2)cc1C
InChIInChI=1S/C16H18O2/c1-12-10-14(4-5-15(12)11-17-2)13-6-8-16(18-3)9-7-13/h4-10H,11H2,1-3H3
InChIKeyHTFKHZIOPWLOCB-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.82
Rot. Bonds4

About 1-(methoxymethyl)-4-(4-methoxyphenyl)-2-methylbenzene

1-(methoxymethyl)-4-(4-methoxyphenyl)-2-methylbenzene (PubChem CID 91108863) has the molecular formula C16H18O2 and a molecular weight of 242.32 g/mol. Its IUPAC name is 1-(methoxymethyl)-4-(4-methoxyphenyl)-2-methylbenzene.

Molecular Properties

Compound Name1-(methoxymethyl)-4-(4-methoxyphenyl)-2-methylbenzene
PubChem CID91108863
Molecular FormulaC16H18O2
Molecular Weight242.32 g/mol
Exact Mass242.13
IUPAC Name1-(methoxymethyl)-4-(4-methoxyphenyl)-2-methylbenzene
SMILESCOCc1ccc(-c2ccc(OC)cc2)cc1C
InChIInChI=1S/C16H18O2/c1-12-10-14(4-5-15(12)11-17-2)13-6-8-16(18-3)9-7-13/h4-10H,11H2,1-3H3
InChIKeyHTFKHZIOPWLOCB-UHFFFAOYSA-N
XLogP3.82
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-methoxy-1-(methoxymethyl)-4-(4-methylphenyl)benzene
CID 143812993
5-(4-methoxyphenyl)-1,2,3-trimethylbenzene
CID 132540116
2-methoxy-1-(methoxymethyl)-4-(4-methoxy-2-methylphenyl)benzene
CID 143812999
1,4-bis(methoxymethyl)-2-methylbenzene
CID 19879640
O-[(4-methoxy-2-methylphenyl)methyl]hydroxylamine
CID 117276532
1-ethyl-4-methoxy-2-(methoxymethyl)benzene
CID 143738113
4-methoxy-1-[(4-methoxyphenyl)methyl]-2-methylbenzene
CID 15654338
2-methoxy-6-(4-methoxyphenyl)naphthalene
CID 11149734
2-(4-methoxyphenyl)-6-methylnaphthalene
CID 15099897
methane;1-methoxy-4-(4-methylphenyl)benzene
CID 159881054
4-[(4-methoxyphenoxy)methyl]-3-methylbenzonitrile
CID 114481488
[4-(methoxymethyl)-3-methylphenyl]methanamine
CID 88997132

Frequently Asked Questions

What is the IUPAC name of 1-(methoxymethyl)-4-(4-methoxyphenyl)-2-methylbenzene?
The IUPAC name of 1-(methoxymethyl)-4-(4-methoxyphenyl)-2-methylbenzene (CID 91108863) is 1-(methoxymethyl)-4-(4-methoxyphenyl)-2-methylbenzene.
What is the SMILES notation for 1-(methoxymethyl)-4-(4-methoxyphenyl)-2-methylbenzene?
The canonical SMILES for 1-(methoxymethyl)-4-(4-methoxyphenyl)-2-methylbenzene is COCc1ccc(-c2ccc(OC)cc2)cc1C.
What is the InChIKey of 1-(methoxymethyl)-4-(4-methoxyphenyl)-2-methylbenzene?
The InChIKey is HTFKHZIOPWLOCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O2/c1-12-10-14(4-5-15(12)11-17-2)13-6-8-16(18-3)9-7-13/h4-10H,11H2,1-3H3.
What are the key properties of 1-(methoxymethyl)-4-(4-methoxyphenyl)-2-methylbenzene?
1-(methoxymethyl)-4-(4-methoxyphenyl)-2-methylbenzene has a molecular weight of 242.32 g/mol, XLogP of 3.82, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methoxymethyl)-4-(4-methoxyphenyl)-2-methylbenzene is sourced from PubChem (CID 91108863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).