1-ethenyl-4-[1-[2-(4-methoxyphenoxy)ethoxy]ethoxy]benzene;1-[1-(4-ethenylphenoxy)ethoxy]adamantane;2-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]bicyclo[2.2.1]heptane;4-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]tetracyclo[6.2.1.13,6.02,7]dodecane;1-[1-(4-ethenylphenoxy)ethoxymethyl]adamantane;1-ethenyl-4-[1-[2-(4-phenoxyphenoxy)ethoxy]ethoxy]benzene

C127H158O16 — CID 161381387

IUPAC1-ethenyl-4-[1-[2-(4-methoxyphenoxy)ethoxy]ethoxy]benzene;1-[1-(4-ethenylphenoxy)ethoxy]adamantane;2-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]bicyclo[2.2.1]heptane;4-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]tetracyclo[6.2.1.13,6.02,7]dodecane;1-[1-(4-ethenylphenoxy)ethoxymethyl]adamantane;1-ethenyl-4-[1-[2-(4-phenoxyphenoxy)ethoxy]ethoxy]benzene
SMILESC=Cc1ccc(OC(C)OC23CC4CC(CC(C4)C2)C3)cc1.C=Cc1ccc(OC(C)OCC23CC4CC(CC(C4)C2)C3)cc1.C=Cc1ccc(OC(C)OCCC2CC3CC2C2C4CCC(C4)C32)cc1.C=Cc1ccc(OC(C)OCCC2CC3CCC2C3)cc1.C=Cc1ccc(OC(C)OCCOc2ccc(OC)cc2)cc1.C=Cc1ccc(OC(C)OCCOc2ccc(Oc3ccccc3)cc2)cc1
InChIInChI=1S/C24H24O4.C24H32O2.C21H28O2.C20H26O2.C19H22O4.C19H26O2/c1-3-20-9-11-23(12-10-20)27-19(2)25-17-18-26-21-13-15-24(16-14-21)28-22-7-5-4-6-8-22;1-3-16-4-8-21(9-5-16)26-15(2)25-11-10-17-12-20-14-22(17)24-19-7-6-18(13-19)23(20)24;1-3-16-4-6-20(7-5-16)23-15(2)22-14-21-11-17-8-18(12-21)10-19(9-17)13-21;1-3-15-4-6-19(7-5-15)21-14(2)22-20-11-16-8-17(12-20)10-18(9-16)13-20;1-4-16-5-7-19(8-6-16)23-15(2)21-13-14-22-18-11-9-17(20-3)10-12-18;1-3-15-5-8-19(9-6-15)21-14(2)20-11-10-18-13-16-4-7-17(18)12-16/h3-16,19H,1,17-18H2,2H3;3-5,8-9,15,17-20,22-24H,1,6-7,10-14H2,2H3;3-7,15,17-19H,1,8-14H2,2H3;3-7,14,16-18H,1,8-13H2,2H3;4-12,15H,1,13-14H2,2-3H3;3,5-6,8-9,14,16-18H,1,4,7,10-13H2,2H3
InChIKeyVRTOQGDIFVBUBU-UHFFFAOYSA-N
MW1940.64 g/mol
LogP31.10
Rot. Bonds44

About 1-ethenyl-4-[1-[2-(4-methoxyphenoxy)ethoxy]ethoxy]benzene;1-[1-(4-ethenylphenoxy)ethoxy]adamantane;2-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]bicyclo[2.2.1]heptane;4-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]tetracyclo[6.2.1.13,6.02,7]dodecane;1-[1-(4-ethenylphenoxy)ethoxymethyl]adamantane;1-ethenyl-4-[1-[2-(4-phenoxyphenoxy)ethoxy]ethoxy]benzene

1-ethenyl-4-[1-[2-(4-methoxyphenoxy)ethoxy]ethoxy]benzene;1-[1-(4-ethenylphenoxy)ethoxy]adamantane;2-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]bicyclo[2.2.1]heptane;4-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]tetracyclo[6.2.1.13,6.02,7]dodecane;1-[1-(4-ethenylphenoxy)ethoxymethyl]adamantane;1-ethenyl-4-[1-[2-(4-phenoxyphenoxy)ethoxy]ethoxy]benzene (PubChem CID 161381387) has the molecular formula C127H158O16 and a molecular weight of 1940.64 g/mol. Its IUPAC name is 1-ethenyl-4-[1-[2-(4-methoxyphenoxy)ethoxy]ethoxy]benzene;1-[1-(4-ethenylphenoxy)ethoxy]adamantane;2-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]bicyclo[2.2.1]heptane;4-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]tetracyclo[6.2.1.13,6.02,7]dodecane;1-[1-(4-ethenylphenoxy)ethoxymethyl]adamantane;1-ethenyl-4-[1-[2-(4-phenoxyphenoxy)ethoxy]ethoxy]benzene.

Molecular Properties

Compound Name1-ethenyl-4-[1-[2-(4-methoxyphenoxy)ethoxy]ethoxy]benzene;1-[1-(4-ethenylphenoxy)ethoxy]adamantane;2-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]bicyclo[2.2.1]heptane;4-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]tetracyclo[6.2.1.13,6.02,7]dodecane;1-[1-(4-ethenylphenoxy)ethoxymethyl]adamantane;1-ethenyl-4-[1-[2-(4-phenoxyphenoxy)ethoxy]ethoxy]benzene
PubChem CID161381387
Molecular FormulaC127H158O16
Molecular Weight1940.64 g/mol
Exact Mass1939.15
IUPAC Name1-ethenyl-4-[1-[2-(4-methoxyphenoxy)ethoxy]ethoxy]benzene;1-[1-(4-ethenylphenoxy)ethoxy]adamantane;2-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]bicyclo[2.2.1]heptane;4-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]tetracyclo[6.2.1.13,6.02,7]dodecane;1-[1-(4-ethenylphenoxy)ethoxymethyl]adamantane;1-ethenyl-4-[1-[2-(4-phenoxyphenoxy)ethoxy]ethoxy]benzene
SMILESC=Cc1ccc(OC(C)OC23CC4CC(CC(C4)C2)C3)cc1.C=Cc1ccc(OC(C)OCC23CC4CC(CC(C4)C2)C3)cc1.C=Cc1ccc(OC(C)OCCC2CC3CC2C2C4CCC(C4)C32)cc1.C=Cc1ccc(OC(C)OCCC2CC3CCC2C3)cc1.C=Cc1ccc(OC(C)OCCOc2ccc(OC)cc2)cc1.C=Cc1ccc(OC(C)OCCOc2ccc(Oc3ccccc3)cc2)cc1
InChIInChI=1S/C24H24O4.C24H32O2.C21H28O2.C20H26O2.C19H22O4.C19H26O2/c1-3-20-9-11-23(12-10-20)27-19(2)25-17-18-26-21-13-15-24(16-14-21)28-22-7-5-4-6-8-22;1-3-16-4-8-21(9-5-16)26-15(2)25-11-10-17-12-20-14-22(17)24-19-7-6-18(13-19)23(20)24;1-3-16-4-6-20(7-5-16)23-15(2)22-14-21-11-17-8-18(12-21)10-19(9-17)13-21;1-3-15-4-6-19(7-5-15)21-14(2)22-20-11-16-8-17(12-20)10-18(9-16)13-20;1-4-16-5-7-19(8-6-16)23-15(2)21-13-14-22-18-11-9-17(20-3)10-12-18;1-3-15-5-8-19(9-6-15)21-14(2)20-11-10-18-13-16-4-7-17(18)12-16/h3-16,19H,1,17-18H2,2H3;3-5,8-9,15,17-20,22-24H,1,6-7,10-14H2,2H3;3-7,15,17-19H,1,8-14H2,2H3;3-7,14,16-18H,1,8-13H2,2H3;4-12,15H,1,13-14H2,2-3H3;3,5-6,8-9,14,16-18H,1,4,7,10-13H2,2H3
InChIKeyVRTOQGDIFVBUBU-UHFFFAOYSA-N
XLogP31.10
TPSA147.68 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds44
Heavy Atoms143
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001940.64
LogP ≤ 531.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'cyclooctane_1', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze 1-ethenyl-4-[1-[2-(4-methoxyphenoxy)ethoxy]ethoxy]benzene;1-[1-(4-ethenylphenoxy)ethoxy]adamantane;2-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]bicyclo[2.2.1]heptane;4-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]tetracyclo[6.2.1.13,6.02,7]dodecane;1-[1-(4-ethenylphenoxy)ethoxymethyl]adamantane;1-ethenyl-4-[1-[2-(4-phenoxyphenoxy)ethoxy]ethoxy]benzene with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-4-[1-[2-(4-methoxyphenoxy)ethoxy]ethoxy]benzene;1-[1-(4-ethenylphenoxy)ethoxy]adamantane;2-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]bicyclo[2.2.1]heptane;4-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]tetracyclo[6.2.1.13,6.02,7]dodecane;1-[1-(4-ethenylphenoxy)ethoxymethyl]adamantane;1-ethenyl-4-[1-[2-(4-phenoxyphenoxy)ethoxy]ethoxy]benzene?
The IUPAC name of 1-ethenyl-4-[1-[2-(4-methoxyphenoxy)ethoxy]ethoxy]benzene;1-[1-(4-ethenylphenoxy)ethoxy]adamantane;2-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]bicyclo[2.2.1]heptane;4-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]tetracyclo[6.2.1.13,6.02,7]dodecane;1-[1-(4-ethenylphenoxy)ethoxymethyl]adamantane;1-ethenyl-4-[1-[2-(4-phenoxyphenoxy)ethoxy]ethoxy]benzene (CID 161381387) is 1-ethenyl-4-[1-[2-(4-methoxyphenoxy)ethoxy]ethoxy]benzene;1-[1-(4-ethenylphenoxy)ethoxy]adamantane;2-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]bicyclo[2.2.1]heptane;4-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]tetracyclo[6.2.1.13,6.02,7]dodecane;1-[1-(4-ethenylphenoxy)ethoxymethyl]adamantane;1-ethenyl-4-[1-[2-(4-phenoxyphenoxy)ethoxy]ethoxy]benzene.
What is the SMILES notation for 1-ethenyl-4-[1-[2-(4-methoxyphenoxy)ethoxy]ethoxy]benzene;1-[1-(4-ethenylphenoxy)ethoxy]adamantane;2-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]bicyclo[2.2.1]heptane;4-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]tetracyclo[6.2.1.13,6.02,7]dodecane;1-[1-(4-ethenylphenoxy)ethoxymethyl]adamantane;1-ethenyl-4-[1-[2-(4-phenoxyphenoxy)ethoxy]ethoxy]benzene?
The canonical SMILES for 1-ethenyl-4-[1-[2-(4-methoxyphenoxy)ethoxy]ethoxy]benzene;1-[1-(4-ethenylphenoxy)ethoxy]adamantane;2-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]bicyclo[2.2.1]heptane;4-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]tetracyclo[6.2.1.13,6.02,7]dodecane;1-[1-(4-ethenylphenoxy)ethoxymethyl]adamantane;1-ethenyl-4-[1-[2-(4-phenoxyphenoxy)ethoxy]ethoxy]benzene is C=Cc1ccc(OC(C)OC23CC4CC(CC(C4)C2)C3)cc1.C=Cc1ccc(OC(C)OCC23CC4CC(CC(C4)C2)C3)cc1.C=Cc1ccc(OC(C)OCCC2CC3CC2C2C4CCC(C4)C32)cc1.C=Cc1ccc(OC(C)OCCC2CC3CCC2C3)cc1.C=Cc1ccc(OC(C)OCCOc2ccc(OC)cc2)cc1.C=Cc1ccc(OC(C)OCCOc2ccc(Oc3ccccc3)cc2)cc1.
What is the InChIKey of 1-ethenyl-4-[1-[2-(4-methoxyphenoxy)ethoxy]ethoxy]benzene;1-[1-(4-ethenylphenoxy)ethoxy]adamantane;2-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]bicyclo[2.2.1]heptane;4-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]tetracyclo[6.2.1.13,6.02,7]dodecane;1-[1-(4-ethenylphenoxy)ethoxymethyl]adamantane;1-ethenyl-4-[1-[2-(4-phenoxyphenoxy)ethoxy]ethoxy]benzene?
The InChIKey is VRTOQGDIFVBUBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24O4.C24H32O2.C21H28O2.C20H26O2.C19H22O4.C19H26O2/c1-3-20-9-11-23(12-10-20)27-19(2)25-17-18-26-21-13-15-24(16-14-21)28-22-7-5-4-6-8-22;1-3-16-4-8-21(9-5-16)26-15(2)25-11-10-17-12-20-14-22(17)24-19-7-6-18(13-19)23(20)24;1-3-16-4-6-20(7-5-16)23-15(2)22-14-21-11-17-8-18(12-21)10-19(9-17)13-21;1-3-15-4-6-19(7-5-15)21-14(2)22-20-11-16-8-17(12-20)10-18(9-16)13-20;1-4-16-5-7-19(8-6-16)23-15(2)21-13-14-22-18-11-9-17(20-3)10-12-18;1-3-15-5-8-19(9-6-15)21-14(2)20-11-10-18-13-16-4-7-17(18)12-16/h3-16,19H,1,17-18H2,2H3;3-5,8-9,15,17-20,22-24H,1,6-7,10-14H2,2H3;3-7,15,17-19H,1,8-14H2,2H3;3-7,14,16-18H,1,8-13H2,2H3;4-12,15H,1,13-14H2,2-3H3;3,5-6,8-9,14,16-18H,1,4,7,10-13H2,2H3.
What are the key properties of 1-ethenyl-4-[1-[2-(4-methoxyphenoxy)ethoxy]ethoxy]benzene;1-[1-(4-ethenylphenoxy)ethoxy]adamantane;2-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]bicyclo[2.2.1]heptane;4-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]tetracyclo[6.2.1.13,6.02,7]dodecane;1-[1-(4-ethenylphenoxy)ethoxymethyl]adamantane;1-ethenyl-4-[1-[2-(4-phenoxyphenoxy)ethoxy]ethoxy]benzene?
1-ethenyl-4-[1-[2-(4-methoxyphenoxy)ethoxy]ethoxy]benzene;1-[1-(4-ethenylphenoxy)ethoxy]adamantane;2-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]bicyclo[2.2.1]heptane;4-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]tetracyclo[6.2.1.13,6.02,7]dodecane;1-[1-(4-ethenylphenoxy)ethoxymethyl]adamantane;1-ethenyl-4-[1-[2-(4-phenoxyphenoxy)ethoxy]ethoxy]benzene has a molecular weight of 1940.64 g/mol, XLogP of 31.10, 44 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-4-[1-[2-(4-methoxyphenoxy)ethoxy]ethoxy]benzene;1-[1-(4-ethenylphenoxy)ethoxy]adamantane;2-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]bicyclo[2.2.1]heptane;4-[2-[1-(4-ethenylphenoxy)ethoxy]ethyl]tetracyclo[6.2.1.13,6.02,7]dodecane;1-[1-(4-ethenylphenoxy)ethoxymethyl]adamantane;1-ethenyl-4-[1-[2-(4-phenoxyphenoxy)ethoxy]ethoxy]benzene is sourced from PubChem (CID 161381387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).