2-ethenyl-4-methoxy-1-(2-propylpentoxy)benzene

C17H26O2 — CID 174257896

IUPAC2-ethenyl-4-methoxy-1-(2-propylpentoxy)benzene
SMILESC=Cc1cc(OC)ccc1OCC(CCC)CCC
InChIInChI=1S/C17H26O2/c1-5-8-14(9-6-2)13-19-17-11-10-16(18-4)12-15(17)7-3/h7,10-12,14H,3,5-6,8-9,13H2,1-2,4H3
InChIKeyKTSKKKUMBAIFNF-UHFFFAOYSA-N
MW262.39 g/mol
LogP4.93
Rot. Bonds9

About 2-ethenyl-4-methoxy-1-(2-propylpentoxy)benzene

2-ethenyl-4-methoxy-1-(2-propylpentoxy)benzene (PubChem CID 174257896) has the molecular formula C17H26O2 and a molecular weight of 262.39 g/mol. Its IUPAC name is 2-ethenyl-4-methoxy-1-(2-propylpentoxy)benzene.

Molecular Properties

Compound Name2-ethenyl-4-methoxy-1-(2-propylpentoxy)benzene
PubChem CID174257896
Molecular FormulaC17H26O2
Molecular Weight262.39 g/mol
Exact Mass262.19
IUPAC Name2-ethenyl-4-methoxy-1-(2-propylpentoxy)benzene
SMILESC=Cc1cc(OC)ccc1OCC(CCC)CCC
InChIInChI=1S/C17H26O2/c1-5-8-14(9-6-2)13-19-17-11-10-16(18-4)12-15(17)7-3/h7,10-12,14H,3,5-6,8-9,13H2,1-2,4H3
InChIKeyKTSKKKUMBAIFNF-UHFFFAOYSA-N
XLogP4.93
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.39
LogP ≤ 54.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethenyl-1,4-di(tetradecoxy)benzene
CID 102407771
2-(2,2-difluoroethoxy)-5-methoxybenzaldehyde
CID 60922402
2-(2,2-diethoxyethoxy)-5-methoxybenzaldehyde
CID 59603127
5-methoxy-2-(2-methylpentoxy)aniline
CID 62266736
1-ethenyl-2-(2-methoxypentoxy)benzene
CID 173035288
4-[2-[2-(2-ethylhexoxy)-5-methoxyphenyl]ethenyl]-N,N-diphenylaniline
CID 174488589
(2R)-2-[(2-ethenyl-4-methoxyphenyl)methyl]butan-1-ol
CID 66751010
2-[(3-methoxyphenoxy)methyl]pentan-1-ol
CID 117241933
tert-butyl-(2-ethenyl-4-methoxyphenoxy)-dimethylsilane
CID 10945326
5-methoxy-2-undecoxybenzaldehyde
CID 15617492
2-[4-(2-formyl-4-methoxyphenoxy)butoxy]-5-methoxybenzaldehyde
CID 11850864
1-[2-(hydroxymethyl)-4-methoxyphenoxy]butan-2-ol
CID 60886437

Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-4-methoxy-1-(2-propylpentoxy)benzene?
The IUPAC name of 2-ethenyl-4-methoxy-1-(2-propylpentoxy)benzene (CID 174257896) is 2-ethenyl-4-methoxy-1-(2-propylpentoxy)benzene.
What is the SMILES notation for 2-ethenyl-4-methoxy-1-(2-propylpentoxy)benzene?
The canonical SMILES for 2-ethenyl-4-methoxy-1-(2-propylpentoxy)benzene is C=Cc1cc(OC)ccc1OCC(CCC)CCC.
What is the InChIKey of 2-ethenyl-4-methoxy-1-(2-propylpentoxy)benzene?
The InChIKey is KTSKKKUMBAIFNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26O2/c1-5-8-14(9-6-2)13-19-17-11-10-16(18-4)12-15(17)7-3/h7,10-12,14H,3,5-6,8-9,13H2,1-2,4H3.
What are the key properties of 2-ethenyl-4-methoxy-1-(2-propylpentoxy)benzene?
2-ethenyl-4-methoxy-1-(2-propylpentoxy)benzene has a molecular weight of 262.39 g/mol, XLogP of 4.93, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-4-methoxy-1-(2-propylpentoxy)benzene is sourced from PubChem (CID 174257896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).