1-methyl-4-(4-prop-1-en-2-ylphenoxy)benzene

C16H16O — CID 147989654

IUPAC1-methyl-4-(4-prop-1-en-2-ylphenoxy)benzene
SMILESC=C(C)c1ccc(Oc2ccc(C)cc2)cc1
InChIInChI=1S/C16H16O/c1-12(2)14-6-10-16(11-7-14)17-15-8-4-13(3)5-9-15/h4-11H,1H2,2-3H3
InChIKeyIUUWXLCNLYGHDF-UHFFFAOYSA-N
MW224.30 g/mol
LogP4.82
Rot. Bonds3

About 1-methyl-4-(4-prop-1-en-2-ylphenoxy)benzene

1-methyl-4-(4-prop-1-en-2-ylphenoxy)benzene (PubChem CID 147989654) has the molecular formula C16H16O and a molecular weight of 224.30 g/mol. Its IUPAC name is 1-methyl-4-(4-prop-1-en-2-ylphenoxy)benzene.

Molecular Properties

Compound Name1-methyl-4-(4-prop-1-en-2-ylphenoxy)benzene
PubChem CID147989654
Molecular FormulaC16H16O
Molecular Weight224.30 g/mol
Exact Mass224.12
IUPAC Name1-methyl-4-(4-prop-1-en-2-ylphenoxy)benzene
SMILESC=C(C)c1ccc(Oc2ccc(C)cc2)cc1
InChIInChI=1S/C16H16O/c1-12(2)14-6-10-16(11-7-14)17-15-8-4-13(3)5-9-15/h4-11H,1H2,2-3H3
InChIKeyIUUWXLCNLYGHDF-UHFFFAOYSA-N
XLogP4.82
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 54.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-methyl-4-[4-[4-[4-[1-[4-(4-prop-1-en-2-ylphenoxy)phenyl]ethenyl]phenoxy]phenoxy]phenyl]benzene
CID 162199902
1-methyl-4-(4-prop-1-en-2-ylphenyl)benzene
CID 20594776
[4-(4-methylphenoxy)phenyl]-(4-methylphenyl)methanone
CID 22389585
1-methyl-4-(4-methylphenoxy)benzene;dihydrofluoride
CID 174481204
1-[4-[4-[4-[4-[4-(4-methylphenyl)phenoxy]phenoxy]phenyl]phenoxy]phenyl]ethanone
CID 126710300
1-[1-(4-methoxyphenyl)ethenyl]-4-[4-(4-methylphenyl)phenoxy]benzene
CID 162199896
cyclobutane;ethane;1-methyl-4-prop-1-en-2-ylbenzene
CID 177043562
1-[2,2-bis(4-methylphenyl)-1-[4-[4-[(Z)-2-(4-methylphenyl)-1,2-diphenylethenyl]phenoxy]phenyl]ethenyl]-4-methylbenzene
CID 58942110
tris(4-prop-1-en-2-ylphenyl) stiborite
CID 172799165
methanesulfonic acid;1-[4-(4-methylphenoxy)phenyl]ethanone
CID 90969067
methanesulfonic acid;bis(1-[4-[4-(4-methylphenoxy)phenoxy]phenyl]ethanone)
CID 158564217
3,5-dimethyl-2-(4-prop-1-en-2-ylphenoxy)pyridine
CID 167495897

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(4-prop-1-en-2-ylphenoxy)benzene?
The IUPAC name of 1-methyl-4-(4-prop-1-en-2-ylphenoxy)benzene (CID 147989654) is 1-methyl-4-(4-prop-1-en-2-ylphenoxy)benzene.
What is the SMILES notation for 1-methyl-4-(4-prop-1-en-2-ylphenoxy)benzene?
The canonical SMILES for 1-methyl-4-(4-prop-1-en-2-ylphenoxy)benzene is C=C(C)c1ccc(Oc2ccc(C)cc2)cc1.
What is the InChIKey of 1-methyl-4-(4-prop-1-en-2-ylphenoxy)benzene?
The InChIKey is IUUWXLCNLYGHDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O/c1-12(2)14-6-10-16(11-7-14)17-15-8-4-13(3)5-9-15/h4-11H,1H2,2-3H3.
What are the key properties of 1-methyl-4-(4-prop-1-en-2-ylphenoxy)benzene?
1-methyl-4-(4-prop-1-en-2-ylphenoxy)benzene has a molecular weight of 224.30 g/mol, XLogP of 4.82, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(4-prop-1-en-2-ylphenoxy)benzene is sourced from PubChem (CID 147989654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).