1-ethenyl-4-methoxybenzene

C9H10O — CID 12507

IUPAC1-ethenyl-4-methoxybenzene
SMILESC=Cc1ccc(OC)cc1
InChIInChI=1S/C9H10O/c1-3-8-4-6-9(10-2)7-5-8/h3-7H,1H2,2H3
InChIKeyUAJRSHJHFRVGMG-UHFFFAOYSA-N
MW134.18 g/mol
LogP2.34
Rot. Bonds2

About 1-ethenyl-4-methoxybenzene

1-ethenyl-4-methoxybenzene (PubChem CID 12507) has the molecular formula C9H10O and a molecular weight of 134.18 g/mol. Its IUPAC name is 1-ethenyl-4-methoxybenzene.

Molecular Properties

Compound Name1-ethenyl-4-methoxybenzene
PubChem CID12507
Molecular FormulaC9H10O
Molecular Weight134.18 g/mol
Exact Mass134.07
IUPAC Name1-ethenyl-4-methoxybenzene
SMILESC=Cc1ccc(OC)cc1
InChIInChI=1S/C9H10O/c1-3-8-4-6-9(10-2)7-5-8/h3-7H,1H2,2H3
InChIKeyUAJRSHJHFRVGMG-UHFFFAOYSA-N
XLogP2.34
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-4-methoxybenzene?
The IUPAC name of 1-ethenyl-4-methoxybenzene (CID 12507) is 1-ethenyl-4-methoxybenzene.
What is the SMILES notation for 1-ethenyl-4-methoxybenzene?
The canonical SMILES for 1-ethenyl-4-methoxybenzene is C=Cc1ccc(OC)cc1.
What is the InChIKey of 1-ethenyl-4-methoxybenzene?
The InChIKey is UAJRSHJHFRVGMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10O/c1-3-8-4-6-9(10-2)7-5-8/h3-7H,1H2,2H3.
What are the key properties of 1-ethenyl-4-methoxybenzene?
1-ethenyl-4-methoxybenzene has a molecular weight of 134.18 g/mol, XLogP of 2.34, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-4-methoxybenzene is sourced from PubChem (CID 12507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).