1,5-dimethoxy-2,4-bis[1-(4-phenylphenyl)ethenyl]benzene

C36H30O2 — CID 132542324

IUPAC1,5-dimethoxy-2,4-bis[1-(4-phenylphenyl)ethenyl]benzene
SMILESC=C(c1ccc(-c2ccccc2)cc1)c1cc(C(=C)c2ccc(-c3ccccc3)cc2)c(OC)cc1OC
InChIInChI=1S/C36H30O2/c1-25(27-15-19-31(20-16-27)29-11-7-5-8-12-29)33-23-34(36(38-4)24-35(33)37-3)26(2)28-17-21-32(22-18-28)30-13-9-6-10-14-30/h5-24H,1-2H2,3-4H3
InChIKeyVURHPZSRQSVUTH-UHFFFAOYSA-N
MW494.63 g/mol
LogP9.16
Rot. Bonds8

About 1,5-dimethoxy-2,4-bis[1-(4-phenylphenyl)ethenyl]benzene

1,5-dimethoxy-2,4-bis[1-(4-phenylphenyl)ethenyl]benzene (PubChem CID 132542324) has the molecular formula C36H30O2 and a molecular weight of 494.63 g/mol. Its IUPAC name is 1,5-dimethoxy-2,4-bis[1-(4-phenylphenyl)ethenyl]benzene.

Molecular Properties

Compound Name1,5-dimethoxy-2,4-bis[1-(4-phenylphenyl)ethenyl]benzene
PubChem CID132542324
Molecular FormulaC36H30O2
Molecular Weight494.63 g/mol
Exact Mass494.22
IUPAC Name1,5-dimethoxy-2,4-bis[1-(4-phenylphenyl)ethenyl]benzene
SMILESC=C(c1ccc(-c2ccccc2)cc1)c1cc(C(=C)c2ccc(-c3ccccc3)cc2)c(OC)cc1OC
InChIInChI=1S/C36H30O2/c1-25(27-15-19-31(20-16-27)29-11-7-5-8-12-29)33-23-34(36(38-4)24-35(33)37-3)26(2)28-17-21-32(22-18-28)30-13-9-6-10-14-30/h5-24H,1-2H2,3-4H3
InChIKeyVURHPZSRQSVUTH-UHFFFAOYSA-N
XLogP9.16
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500494.63
LogP ≤ 59.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-1-methoxy-4-(1-phenylethenyl)benzene
CID 71342253
1-(4-phenylphenyl)ethenol
CID 89336300
N-methoxy-1-(4-phenylphenyl)ethenamine
CID 57139262
(3-fluoro-4-methoxyphenyl)-(4-phenylphenyl)methanone
CID 146005301
5-methoxy-2-(1-phenylethenyl)phenol
CID 11064138
[2-(2,4-dimethoxyphenyl)-2-oxoethyl] 4-phenylbenzoate
CID 2520644
methyl 4-methoxy-3-phenylbenzoate
CID 11010121
2-fluoro-4-methoxy-1-(1-phenylethenyl)benzene
CID 156698107
1,2,4-trimethoxy-5-phenylbenzene
CID 18788699
1-[1-(2-methoxyphenyl)ethenyl]pyridin-1-ium
CID 67753727
(2-fluoro-6-methoxyphenyl)-(4-phenylphenyl)methanone
CID 146005289
1-(4-phenylphenyl)ethenethiol
CID 142504756

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethoxy-2,4-bis[1-(4-phenylphenyl)ethenyl]benzene?
The IUPAC name of 1,5-dimethoxy-2,4-bis[1-(4-phenylphenyl)ethenyl]benzene (CID 132542324) is 1,5-dimethoxy-2,4-bis[1-(4-phenylphenyl)ethenyl]benzene.
What is the SMILES notation for 1,5-dimethoxy-2,4-bis[1-(4-phenylphenyl)ethenyl]benzene?
The canonical SMILES for 1,5-dimethoxy-2,4-bis[1-(4-phenylphenyl)ethenyl]benzene is C=C(c1ccc(-c2ccccc2)cc1)c1cc(C(=C)c2ccc(-c3ccccc3)cc2)c(OC)cc1OC.
What is the InChIKey of 1,5-dimethoxy-2,4-bis[1-(4-phenylphenyl)ethenyl]benzene?
The InChIKey is VURHPZSRQSVUTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H30O2/c1-25(27-15-19-31(20-16-27)29-11-7-5-8-12-29)33-23-34(36(38-4)24-35(33)37-3)26(2)28-17-21-32(22-18-28)30-13-9-6-10-14-30/h5-24H,1-2H2,3-4H3.
What are the key properties of 1,5-dimethoxy-2,4-bis[1-(4-phenylphenyl)ethenyl]benzene?
1,5-dimethoxy-2,4-bis[1-(4-phenylphenyl)ethenyl]benzene has a molecular weight of 494.63 g/mol, XLogP of 9.16, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethoxy-2,4-bis[1-(4-phenylphenyl)ethenyl]benzene is sourced from PubChem (CID 132542324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).