2-chloro-4-ethenyl-1-methoxybenzene

C9H9ClO — CID 11147958

IUPAC2-chloro-4-ethenyl-1-methoxybenzene
SMILESC=Cc1ccc(OC)c(Cl)c1
InChIInChI=1S/C9H9ClO/c1-3-7-4-5-9(11-2)8(10)6-7/h3-6H,1H2,2H3
InChIKeyVEAQVEYNUAWUMC-UHFFFAOYSA-N
MW168.62 g/mol
LogP2.99
Rot. Bonds2

About 2-chloro-4-ethenyl-1-methoxybenzene

2-chloro-4-ethenyl-1-methoxybenzene (PubChem CID 11147958) has the molecular formula C9H9ClO and a molecular weight of 168.62 g/mol. Its IUPAC name is 2-chloro-4-ethenyl-1-methoxybenzene.

Molecular Properties

Compound Name2-chloro-4-ethenyl-1-methoxybenzene
PubChem CID11147958
Molecular FormulaC9H9ClO
Molecular Weight168.62 g/mol
Exact Mass168.03
IUPAC Name2-chloro-4-ethenyl-1-methoxybenzene
SMILESC=Cc1ccc(OC)c(Cl)c1
InChIInChI=1S/C9H9ClO/c1-3-7-4-5-9(11-2)8(10)6-7/h3-6H,1H2,2H3
InChIKeyVEAQVEYNUAWUMC-UHFFFAOYSA-N
XLogP2.99
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.62
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-ethenyl-1,2-dimethoxybenzene
CID 159733418
3-chloro-4-methoxy(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-triene-1-carbaldehyde
CID 101137815
(E)-4-(3-chloro-4-methoxyphenyl)but-3-en-2-one
CID 65021560
2-[chloro(methoxy)methyl]-4-ethenyl-1-methoxybenzene
CID 21064592
3-(3-chloro-4-methoxyphenyl)-2-methylprop-2-en-1-ol
CID 79334564
4-(3-chloro-4-methoxyphenyl)but-3-enal
CID 91126209
4-ethenyl-2-ethoxy-1-methoxybenzene
CID 11665489
(Z)-3-(3-chloro-4-methoxyphenyl)-2-methylprop-2-en-1-amine
CID 131431095
2-chloro-1-methoxy-4-[(E)-2-nitroethenyl]benzene
CID 65022390
4-ethenyl-2-methoxy-1-(methoxymethoxy)benzene
CID 59623316
4-ethenyl-1-methoxy-2-(4-methylphenyl)benzene
CID 172879757
5-[(3-chloro-4-methoxyphenyl)methylidene]-3-prop-2-enylimidazolidine-2,4-dione
CID 4654737

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-ethenyl-1-methoxybenzene?
The IUPAC name of 2-chloro-4-ethenyl-1-methoxybenzene (CID 11147958) is 2-chloro-4-ethenyl-1-methoxybenzene.
What is the SMILES notation for 2-chloro-4-ethenyl-1-methoxybenzene?
The canonical SMILES for 2-chloro-4-ethenyl-1-methoxybenzene is C=Cc1ccc(OC)c(Cl)c1.
What is the InChIKey of 2-chloro-4-ethenyl-1-methoxybenzene?
The InChIKey is VEAQVEYNUAWUMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9ClO/c1-3-7-4-5-9(11-2)8(10)6-7/h3-6H,1H2,2H3.
What are the key properties of 2-chloro-4-ethenyl-1-methoxybenzene?
2-chloro-4-ethenyl-1-methoxybenzene has a molecular weight of 168.62 g/mol, XLogP of 2.99, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-ethenyl-1-methoxybenzene is sourced from PubChem (CID 11147958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).