(2-ethenylphenyl)methanol;3-trimethoxysilylpropyl 2-methylprop-2-enoate

C19H30O6Si — CID 174809447

IUPAC(2-ethenylphenyl)methanol;3-trimethoxysilylpropyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCC[Si](OC)(OC)OC.C=Cc1ccccc1CO
InChIInChI=1S/C10H20O5Si.C9H10O/c1-9(2)10(11)15-7-6-8-16(12-3,13-4)14-5;1-2-8-5-3-4-6-9(8)7-10/h1,6-8H2,2-5H3;2-6,10H,1,7H2
InChIKeyIQQUXLBRMOLIBA-UHFFFAOYSA-N
MW382.53 g/mol
LogP3.20
Rot. Bonds10

About (2-ethenylphenyl)methanol;3-trimethoxysilylpropyl 2-methylprop-2-enoate

(2-ethenylphenyl)methanol;3-trimethoxysilylpropyl 2-methylprop-2-enoate (PubChem CID 174809447) has the molecular formula C19H30O6Si and a molecular weight of 382.53 g/mol. Its IUPAC name is (2-ethenylphenyl)methanol;3-trimethoxysilylpropyl 2-methylprop-2-enoate.

Molecular Properties

Compound Name(2-ethenylphenyl)methanol;3-trimethoxysilylpropyl 2-methylprop-2-enoate
PubChem CID174809447
Molecular FormulaC19H30O6Si
Molecular Weight382.53 g/mol
Exact Mass382.18
IUPAC Name(2-ethenylphenyl)methanol;3-trimethoxysilylpropyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCC[Si](OC)(OC)OC.C=Cc1ccccc1CO
InChIInChI=1S/C10H20O5Si.C9H10O/c1-9(2)10(11)15-7-6-8-16(12-3,13-4)14-5;1-2-8-5-3-4-6-9(8)7-10/h1,6-8H2,2-5H3;2-6,10H,1,7H2
InChIKeyIQQUXLBRMOLIBA-UHFFFAOYSA-N
XLogP3.20
TPSA74.22 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.53
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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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Frequently Asked Questions

What is the IUPAC name of (2-ethenylphenyl)methanol;3-trimethoxysilylpropyl 2-methylprop-2-enoate?
The IUPAC name of (2-ethenylphenyl)methanol;3-trimethoxysilylpropyl 2-methylprop-2-enoate (CID 174809447) is (2-ethenylphenyl)methanol;3-trimethoxysilylpropyl 2-methylprop-2-enoate.
What is the SMILES notation for (2-ethenylphenyl)methanol;3-trimethoxysilylpropyl 2-methylprop-2-enoate?
The canonical SMILES for (2-ethenylphenyl)methanol;3-trimethoxysilylpropyl 2-methylprop-2-enoate is C=C(C)C(=O)OCCC[Si](OC)(OC)OC.C=Cc1ccccc1CO.
What is the InChIKey of (2-ethenylphenyl)methanol;3-trimethoxysilylpropyl 2-methylprop-2-enoate?
The InChIKey is IQQUXLBRMOLIBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O5Si.C9H10O/c1-9(2)10(11)15-7-6-8-16(12-3,13-4)14-5;1-2-8-5-3-4-6-9(8)7-10/h1,6-8H2,2-5H3;2-6,10H,1,7H2.
What are the key properties of (2-ethenylphenyl)methanol;3-trimethoxysilylpropyl 2-methylprop-2-enoate?
(2-ethenylphenyl)methanol;3-trimethoxysilylpropyl 2-methylprop-2-enoate has a molecular weight of 382.53 g/mol, XLogP of 3.20, 10 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethenylphenyl)methanol;3-trimethoxysilylpropyl 2-methylprop-2-enoate is sourced from PubChem (CID 174809447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).