1-ethenyl-4-[(2-ethyl-3-methoxyphenoxy)methoxy]-2-methoxybenzene

C19H22O4 — CID 145229509

IUPAC1-ethenyl-4-[(2-ethyl-3-methoxyphenoxy)methoxy]-2-methoxybenzene
SMILESC=Cc1ccc(OCOc2cccc(OC)c2CC)cc1OC
InChIInChI=1S/C19H22O4/c1-5-14-10-11-15(12-19(14)21-4)22-13-23-18-9-7-8-17(20-3)16(18)6-2/h5,7-12H,1,6,13H2,2-4H3
InChIKeyDNVFCZDOMVSKGB-UHFFFAOYSA-N
MW314.38 g/mol
LogP4.32
Rot. Bonds8

About 1-ethenyl-4-[(2-ethyl-3-methoxyphenoxy)methoxy]-2-methoxybenzene

1-ethenyl-4-[(2-ethyl-3-methoxyphenoxy)methoxy]-2-methoxybenzene (PubChem CID 145229509) has the molecular formula C19H22O4 and a molecular weight of 314.38 g/mol. Its IUPAC name is 1-ethenyl-4-[(2-ethyl-3-methoxyphenoxy)methoxy]-2-methoxybenzene.

Molecular Properties

Compound Name1-ethenyl-4-[(2-ethyl-3-methoxyphenoxy)methoxy]-2-methoxybenzene
PubChem CID145229509
Molecular FormulaC19H22O4
Molecular Weight314.38 g/mol
Exact Mass314.15
IUPAC Name1-ethenyl-4-[(2-ethyl-3-methoxyphenoxy)methoxy]-2-methoxybenzene
SMILESC=Cc1ccc(OCOc2cccc(OC)c2CC)cc1OC
InChIInChI=1S/C19H22O4/c1-5-14-10-11-15(12-19(14)21-4)22-13-23-18-9-7-8-17(20-3)16(18)6-2/h5,7-12H,1,6,13H2,2-4H3
InChIKeyDNVFCZDOMVSKGB-UHFFFAOYSA-N
XLogP4.32
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.38
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-ethoxy-2-ethyl-3-methoxybenzene
CID 155116289
2-ethyl-1,3-bis(methoxymethoxy)benzene
CID 141101427
1-ethenyl-2-ethoxy-3-methoxybenzene
CID 11629687
1-ethenyl-3-ethylbenzene;1-ethenyl-2-methoxybenzene
CID 122483401
1-ethenyl-2-[2-ethenyl-5-(ethoxymethoxy)phenyl]-4-methoxybenzene
CID 167053134
1-ethenyl-4-(2-methoxyethoxymethoxy)-2-phenylmethoxybenzene
CID 6709920
1,2-bis(ethenyl)-4-ethoxybenzene
CID 142802318
1,1'-biphenyl;1-ethenyl-2-methoxybenzene
CID 158702776
1-ethenyl-3-methoxy-2-[(Z)-prop-1-enyl]benzene
CID 88997100
2-chloro-1-ethenyl-4-[(4-methoxyphenyl)methoxy]benzene
CID 134457948
2-(4-ethenyl-3-methoxyphenyl)-N-methylethanamine
CID 144546494
1,3-dimethoxy-2-prop-2-enylbenzene
CID 3014232

Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-4-[(2-ethyl-3-methoxyphenoxy)methoxy]-2-methoxybenzene?
The IUPAC name of 1-ethenyl-4-[(2-ethyl-3-methoxyphenoxy)methoxy]-2-methoxybenzene (CID 145229509) is 1-ethenyl-4-[(2-ethyl-3-methoxyphenoxy)methoxy]-2-methoxybenzene.
What is the SMILES notation for 1-ethenyl-4-[(2-ethyl-3-methoxyphenoxy)methoxy]-2-methoxybenzene?
The canonical SMILES for 1-ethenyl-4-[(2-ethyl-3-methoxyphenoxy)methoxy]-2-methoxybenzene is C=Cc1ccc(OCOc2cccc(OC)c2CC)cc1OC.
What is the InChIKey of 1-ethenyl-4-[(2-ethyl-3-methoxyphenoxy)methoxy]-2-methoxybenzene?
The InChIKey is DNVFCZDOMVSKGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22O4/c1-5-14-10-11-15(12-19(14)21-4)22-13-23-18-9-7-8-17(20-3)16(18)6-2/h5,7-12H,1,6,13H2,2-4H3.
What are the key properties of 1-ethenyl-4-[(2-ethyl-3-methoxyphenoxy)methoxy]-2-methoxybenzene?
1-ethenyl-4-[(2-ethyl-3-methoxyphenoxy)methoxy]-2-methoxybenzene has a molecular weight of 314.38 g/mol, XLogP of 4.32, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-4-[(2-ethyl-3-methoxyphenoxy)methoxy]-2-methoxybenzene is sourced from PubChem (CID 145229509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).