3-benzhydryloxysilylpropyl 2-methylprop-2-enoate

C20H24O3Si — CID 154510518

IUPAC3-benzhydryloxysilylpropyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCC[SiH2]OC(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H24O3Si/c1-16(2)20(21)22-14-9-15-24-23-19(17-10-5-3-6-11-17)18-12-7-4-8-13-18/h3-8,10-13,19H,1,9,14-15,24H2,2H3
InChIKeyYYFHHYSPSRNJGM-UHFFFAOYSA-N
MW340.50 g/mol
LogP3.80
Rot. Bonds9

About 3-benzhydryloxysilylpropyl 2-methylprop-2-enoate

3-benzhydryloxysilylpropyl 2-methylprop-2-enoate (PubChem CID 154510518) has the molecular formula C20H24O3Si and a molecular weight of 340.50 g/mol. Its IUPAC name is 3-benzhydryloxysilylpropyl 2-methylprop-2-enoate.

Molecular Properties

Compound Name3-benzhydryloxysilylpropyl 2-methylprop-2-enoate
PubChem CID154510518
Molecular FormulaC20H24O3Si
Molecular Weight340.50 g/mol
Exact Mass340.15
IUPAC Name3-benzhydryloxysilylpropyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCC[SiH2]OC(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H24O3Si/c1-16(2)20(21)22-14-9-15-24-23-19(17-10-5-3-6-11-17)18-12-7-4-8-13-18/h3-8,10-13,19H,1,9,14-15,24H2,2H3
InChIKeyYYFHHYSPSRNJGM-UHFFFAOYSA-N
XLogP3.80
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.50
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-benzhydrylsilylpropyl 2-methylprop-2-enoate
CID 152767258
3-phenylsulfanylpropyl 2-methylprop-2-enoate
CID 140680016
3-[diphenyl(silyloxy)silyl]oxysilylpropyl 2-methylprop-2-enoate
CID 175109238
CID 175978198
CID 175978198
4-phenylbutyl 2-methylprop-2-enoate
CID 22507477
3-(2-methylprop-2-enoyloxy)propyl-triphenylphosphanium bromide
CID 175823134
3-[3-(2-methylprop-2-enoyloxy)propylsilyl]propyl 2-methylprop-2-enoate
CID 175549235
2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate;toluene
CID 163489883
4-[4-(4-phenoxybutoxy)butoxy]butyl 2-methylprop-2-enoate
CID 139664490
1-chloroprop-2-enylbenzene;dodecyl 2-methylprop-2-enoate
CID 166691897
benzene;pentyl 2-methylprop-2-enoate
CID 174465726
4-trityloxybutyl 2-methylprop-2-enoate
CID 141487802

Frequently Asked Questions

What is the IUPAC name of 3-benzhydryloxysilylpropyl 2-methylprop-2-enoate?
The IUPAC name of 3-benzhydryloxysilylpropyl 2-methylprop-2-enoate (CID 154510518) is 3-benzhydryloxysilylpropyl 2-methylprop-2-enoate.
What is the SMILES notation for 3-benzhydryloxysilylpropyl 2-methylprop-2-enoate?
The canonical SMILES for 3-benzhydryloxysilylpropyl 2-methylprop-2-enoate is C=C(C)C(=O)OCCC[SiH2]OC(c1ccccc1)c1ccccc1.
What is the InChIKey of 3-benzhydryloxysilylpropyl 2-methylprop-2-enoate?
The InChIKey is YYFHHYSPSRNJGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24O3Si/c1-16(2)20(21)22-14-9-15-24-23-19(17-10-5-3-6-11-17)18-12-7-4-8-13-18/h3-8,10-13,19H,1,9,14-15,24H2,2H3.
What are the key properties of 3-benzhydryloxysilylpropyl 2-methylprop-2-enoate?
3-benzhydryloxysilylpropyl 2-methylprop-2-enoate has a molecular weight of 340.50 g/mol, XLogP of 3.80, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-benzhydryloxysilylpropyl 2-methylprop-2-enoate is sourced from PubChem (CID 154510518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).