[(Z)-3-(4-methoxyphenyl)-1-phenyl-3-(2,4,6-trimethylphenyl)prop-1-enoxy]-trimethylsilane

C28H34O2Si — CID 102313834

IUPAC[(Z)-3-(4-methoxyphenyl)-1-phenyl-3-(2,4,6-trimethylphenyl)prop-1-enoxy]-trimethylsilane
SMILESCOc1ccc(C(/C=C(\O[Si](C)(C)C)c2ccccc2)c2c(C)cc(C)cc2C)cc1
InChIInChI=1S/C28H34O2Si/c1-20-17-21(2)28(22(3)18-20)26(23-13-15-25(29-4)16-14-23)19-27(30-31(5,6)7)24-11-9-8-10-12-24/h8-19,26H,1-7H3/b27-19-
InChIKeySOKAGXTWZCBUJY-DIBXZPPDSA-N
MW430.66 g/mol
LogP7.64
Rot. Bonds7

About [(Z)-3-(4-methoxyphenyl)-1-phenyl-3-(2,4,6-trimethylphenyl)prop-1-enoxy]-trimethylsilane

[(Z)-3-(4-methoxyphenyl)-1-phenyl-3-(2,4,6-trimethylphenyl)prop-1-enoxy]-trimethylsilane (PubChem CID 102313834) has the molecular formula C28H34O2Si and a molecular weight of 430.66 g/mol. Its IUPAC name is [(Z)-3-(4-methoxyphenyl)-1-phenyl-3-(2,4,6-trimethylphenyl)prop-1-enoxy]-trimethylsilane.

Molecular Properties

Compound Name[(Z)-3-(4-methoxyphenyl)-1-phenyl-3-(2,4,6-trimethylphenyl)prop-1-enoxy]-trimethylsilane
PubChem CID102313834
Molecular FormulaC28H34O2Si
Molecular Weight430.66 g/mol
Exact Mass430.23
IUPAC Name[(Z)-3-(4-methoxyphenyl)-1-phenyl-3-(2,4,6-trimethylphenyl)prop-1-enoxy]-trimethylsilane
SMILESCOc1ccc(C(/C=C(\O[Si](C)(C)C)c2ccccc2)c2c(C)cc(C)cc2C)cc1
InChIInChI=1S/C28H34O2Si/c1-20-17-21(2)28(22(3)18-20)26(23-13-15-25(29-4)16-14-23)19-27(30-31(5,6)7)24-11-9-8-10-12-24/h8-19,26H,1-7H3/b27-19-
InChIKeySOKAGXTWZCBUJY-DIBXZPPDSA-N
XLogP7.64
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500430.66
LogP ≤ 57.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

[(Z)-5,5-bis(4-methoxyphenyl)-3-phenylpent-3-en-1-ynyl]-trimethylsilane
CID 12968057
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1-methoxy-4-[(1R)-1-phenylprop-2-enyl]benzene
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(2-methoxy-4,6-dimethylphenyl)-(4-methoxyphenyl)methanamine
CID 106680347
(4-methoxyphenyl)-(4-methylquinolin-2-yl)methanol
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3-[(4-methoxyphenyl)-(2,4,6-trimethylphenyl)methyl]-1H-indole
CID 3705119
2-(4-methoxyphenyl)-4,6-diphenylpyrimidine
CID 12706669
4-[(4-methoxyphenyl)-phenylmethyl]-2-methylphenol
CID 10804464
1-[bis[4-[(4-methoxyphenyl)-phenylmethyl]phenyl]methyl]-4-methoxybenzene
CID 70877905
1-(2,5-dimethylphenyl)-3-[(R)-(4-methoxyphenyl)-phenylmethyl]thiourea
CID 9216135
(Z)-1-(4-methoxyphenyl)-3-phenyl-3-tributylstannyloxyprop-2-en-1-ol
CID 16686478
6-methoxy-N-[(4-methylphenyl)-phenylmethyl]quinoline-2-carboxamide
CID 47016616

Frequently Asked Questions

What is the IUPAC name of [(Z)-3-(4-methoxyphenyl)-1-phenyl-3-(2,4,6-trimethylphenyl)prop-1-enoxy]-trimethylsilane?
The IUPAC name of [(Z)-3-(4-methoxyphenyl)-1-phenyl-3-(2,4,6-trimethylphenyl)prop-1-enoxy]-trimethylsilane (CID 102313834) is [(Z)-3-(4-methoxyphenyl)-1-phenyl-3-(2,4,6-trimethylphenyl)prop-1-enoxy]-trimethylsilane.
What is the SMILES notation for [(Z)-3-(4-methoxyphenyl)-1-phenyl-3-(2,4,6-trimethylphenyl)prop-1-enoxy]-trimethylsilane?
The canonical SMILES for [(Z)-3-(4-methoxyphenyl)-1-phenyl-3-(2,4,6-trimethylphenyl)prop-1-enoxy]-trimethylsilane is COc1ccc(C(/C=C(\O[Si](C)(C)C)c2ccccc2)c2c(C)cc(C)cc2C)cc1.
What is the InChIKey of [(Z)-3-(4-methoxyphenyl)-1-phenyl-3-(2,4,6-trimethylphenyl)prop-1-enoxy]-trimethylsilane?
The InChIKey is SOKAGXTWZCBUJY-DIBXZPPDSA-N. The full InChI is InChI=1S/C28H34O2Si/c1-20-17-21(2)28(22(3)18-20)26(23-13-15-25(29-4)16-14-23)19-27(30-31(5,6)7)24-11-9-8-10-12-24/h8-19,26H,1-7H3/b27-19-.
What are the key properties of [(Z)-3-(4-methoxyphenyl)-1-phenyl-3-(2,4,6-trimethylphenyl)prop-1-enoxy]-trimethylsilane?
[(Z)-3-(4-methoxyphenyl)-1-phenyl-3-(2,4,6-trimethylphenyl)prop-1-enoxy]-trimethylsilane has a molecular weight of 430.66 g/mol, XLogP of 7.64, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-3-(4-methoxyphenyl)-1-phenyl-3-(2,4,6-trimethylphenyl)prop-1-enoxy]-trimethylsilane is sourced from PubChem (CID 102313834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).