1-(methoxymethyl)-4-[4-(2-methylpropyl)phenyl]benzene

C18H22O — CID 149288523

IUPAC1-(methoxymethyl)-4-[4-(2-methylpropyl)phenyl]benzene
SMILESCOCc1ccc(-c2ccc(CC(C)C)cc2)cc1
InChIInChI=1S/C18H22O/c1-14(2)12-15-4-8-17(9-5-15)18-10-6-16(7-11-18)13-19-3/h4-11,14H,12-13H2,1-3H3
InChIKeyXUJNZFBCNWMEIQ-UHFFFAOYSA-N
MW254.37 g/mol
LogP4.70
Rot. Bonds5

About 1-(methoxymethyl)-4-[4-(2-methylpropyl)phenyl]benzene

1-(methoxymethyl)-4-[4-(2-methylpropyl)phenyl]benzene (PubChem CID 149288523) has the molecular formula C18H22O and a molecular weight of 254.37 g/mol. Its IUPAC name is 1-(methoxymethyl)-4-[4-(2-methylpropyl)phenyl]benzene.

Molecular Properties

Compound Name1-(methoxymethyl)-4-[4-(2-methylpropyl)phenyl]benzene
PubChem CID149288523
Molecular FormulaC18H22O
Molecular Weight254.37 g/mol
Exact Mass254.17
IUPAC Name1-(methoxymethyl)-4-[4-(2-methylpropyl)phenyl]benzene
SMILESCOCc1ccc(-c2ccc(CC(C)C)cc2)cc1
InChIInChI=1S/C18H22O/c1-14(2)12-15-4-8-17(9-5-15)18-10-6-16(7-11-18)13-19-3/h4-11,14H,12-13H2,1-3H3
InChIKeyXUJNZFBCNWMEIQ-UHFFFAOYSA-N
XLogP4.70
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 54.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(methoxymethyl)-4-phenylbenzene
CID 14906855
1-(2-methoxyethyl)-4-(2-methylpropyl)benzene
CID 67638248
1-(methoxymethyl)-4-(propan-2-yloxymethyl)benzene
CID 70670788
N-methyl-4-[4-(2-methylpropyl)phenyl]aniline
CID 116962445
formaldehyde;1-(methoxymethyl)-4-phenylbenzene
CID 168878800
methane;1-(methoxymethyl)-4-methylbenzene
CID 158294039
azane;1-(methoxymethyl)-4-methylbenzene
CID 175555359
1-(3-methylbutoxy)-4-[4-(2-methylpropyl)phenyl]benzene
CID 169289853
1-[4-[4-(methoxymethyl)phenyl]phenyl]propan-1-amine
CID 141183609
1-[(dihydroxyamino)oxymethyl]-4-(2-methylpropyl)benzene
CID 89081288
1-(1-methoxypropan-2-yl)-4-(2-methylpropyl)benzene
CID 134395846
1-ethenyl-4-[4-(methoxymethyl)phenyl]benzene
CID 22186395

Frequently Asked Questions

What is the IUPAC name of 1-(methoxymethyl)-4-[4-(2-methylpropyl)phenyl]benzene?
The IUPAC name of 1-(methoxymethyl)-4-[4-(2-methylpropyl)phenyl]benzene (CID 149288523) is 1-(methoxymethyl)-4-[4-(2-methylpropyl)phenyl]benzene.
What is the SMILES notation for 1-(methoxymethyl)-4-[4-(2-methylpropyl)phenyl]benzene?
The canonical SMILES for 1-(methoxymethyl)-4-[4-(2-methylpropyl)phenyl]benzene is COCc1ccc(-c2ccc(CC(C)C)cc2)cc1.
What is the InChIKey of 1-(methoxymethyl)-4-[4-(2-methylpropyl)phenyl]benzene?
The InChIKey is XUJNZFBCNWMEIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O/c1-14(2)12-15-4-8-17(9-5-15)18-10-6-16(7-11-18)13-19-3/h4-11,14H,12-13H2,1-3H3.
What are the key properties of 1-(methoxymethyl)-4-[4-(2-methylpropyl)phenyl]benzene?
1-(methoxymethyl)-4-[4-(2-methylpropyl)phenyl]benzene has a molecular weight of 254.37 g/mol, XLogP of 4.70, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methoxymethyl)-4-[4-(2-methylpropyl)phenyl]benzene is sourced from PubChem (CID 149288523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).