[4-[2-[methyl(trimethylsilyloxy)silyl]ethyl]phenyl]methyl prop-2-enoate

C16H26O3Si2 — CID 173310321

IUPAC[4-[2-[methyl(trimethylsilyloxy)silyl]ethyl]phenyl]methyl prop-2-enoate
SMILESC=CC(=O)OCc1ccc(CC[SiH](C)O[Si](C)(C)C)cc1
InChIInChI=1S/C16H26O3Si2/c1-6-16(17)18-13-15-9-7-14(8-10-15)11-12-20(2)19-21(3,4)5/h6-10,20H,1,11-13H2,2-5H3
InChIKeyORUHPHYOXDYAKX-UHFFFAOYSA-N
MW322.55 g/mol
LogP3.66
Rot. Bonds8

About [4-[2-[methyl(trimethylsilyloxy)silyl]ethyl]phenyl]methyl prop-2-enoate

[4-[2-[methyl(trimethylsilyloxy)silyl]ethyl]phenyl]methyl prop-2-enoate (PubChem CID 173310321) has the molecular formula C16H26O3Si2 and a molecular weight of 322.55 g/mol. Its IUPAC name is [4-[2-[methyl(trimethylsilyloxy)silyl]ethyl]phenyl]methyl prop-2-enoate.

Molecular Properties

Compound Name[4-[2-[methyl(trimethylsilyloxy)silyl]ethyl]phenyl]methyl prop-2-enoate
PubChem CID173310321
Molecular FormulaC16H26O3Si2
Molecular Weight322.55 g/mol
Exact Mass322.14
IUPAC Name[4-[2-[methyl(trimethylsilyloxy)silyl]ethyl]phenyl]methyl prop-2-enoate
SMILESC=CC(=O)OCc1ccc(CC[SiH](C)O[Si](C)(C)C)cc1
InChIInChI=1S/C16H26O3Si2/c1-6-16(17)18-13-15-9-7-14(8-10-15)11-12-20(2)19-21(3,4)5/h6-10,20H,1,11-13H2,2-5H3
InChIKeyORUHPHYOXDYAKX-UHFFFAOYSA-N
XLogP3.66
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.55
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

benzyl prop-2-enoate;2-phenylethyl prop-2-enoate
CID 159252010
[4-[4-(prop-2-enoyloxymethyl)benzoyl]phenyl]methyl prop-2-enoate
CID 171722962
(4-methylsulfanylphenyl)methyl prop-2-enoate
CID 171485836
benzyl prop-2-enoate;but-2-enedioic acid
CID 70273802
[4-[[4-(carboxyoxymethyl)phenyl]disulfanyl]phenyl]methyl prop-2-enoate
CID 90058033
[4-[1-[4-(prop-2-enoyloxymethyl)phenyl]propyl]phenyl]methyl prop-2-enoate
CID 174980361
formaldehyde;2-[4-[[4-(prop-2-enoyloxymethyl)phenyl]methyl]phenoxy]ethyl prop-2-enoate
CID 162101397
2-[4-[4-(2-prop-2-enoyloxyethyl)phenyl]phenyl]ethyl prop-2-enoate
CID 58556788
2-benzofuran-5-ylmethyl prop-2-enoate
CID 174509033
2-[4-[4-(6-methoxyhexyl)-N-[4-(prop-2-enoyloxymethyl)phenyl]anilino]phenyl]ethyl prop-2-enoate
CID 58883094
2-(4-ethenylphenyl)ethyl prop-2-enoate
CID 163299720
[4-[4-(prop-2-enoyloxymethyl)benzoyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)benzoate
CID 20718187

Frequently Asked Questions

What is the IUPAC name of [4-[2-[methyl(trimethylsilyloxy)silyl]ethyl]phenyl]methyl prop-2-enoate?
The IUPAC name of [4-[2-[methyl(trimethylsilyloxy)silyl]ethyl]phenyl]methyl prop-2-enoate (CID 173310321) is [4-[2-[methyl(trimethylsilyloxy)silyl]ethyl]phenyl]methyl prop-2-enoate.
What is the SMILES notation for [4-[2-[methyl(trimethylsilyloxy)silyl]ethyl]phenyl]methyl prop-2-enoate?
The canonical SMILES for [4-[2-[methyl(trimethylsilyloxy)silyl]ethyl]phenyl]methyl prop-2-enoate is C=CC(=O)OCc1ccc(CC[SiH](C)O[Si](C)(C)C)cc1.
What is the InChIKey of [4-[2-[methyl(trimethylsilyloxy)silyl]ethyl]phenyl]methyl prop-2-enoate?
The InChIKey is ORUHPHYOXDYAKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26O3Si2/c1-6-16(17)18-13-15-9-7-14(8-10-15)11-12-20(2)19-21(3,4)5/h6-10,20H,1,11-13H2,2-5H3.
What are the key properties of [4-[2-[methyl(trimethylsilyloxy)silyl]ethyl]phenyl]methyl prop-2-enoate?
[4-[2-[methyl(trimethylsilyloxy)silyl]ethyl]phenyl]methyl prop-2-enoate has a molecular weight of 322.55 g/mol, XLogP of 3.66, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-[methyl(trimethylsilyloxy)silyl]ethyl]phenyl]methyl prop-2-enoate is sourced from PubChem (CID 173310321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).