cyclohexyl(dimethyl)silane;methyl prop-2-enoate

C12H24O2Si — CID 174610427

IUPACcyclohexyl(dimethyl)silane;methyl prop-2-enoate
SMILESC=CC(=O)OC.C[SiH](C)C1CCCCC1
InChIInChI=1S/C8H18Si.C4H6O2/c1-9(2)8-6-4-3-5-7-8;1-3-4(5)6-2/h8-9H,3-7H2,1-2H3;3H,1H2,2H3
InChIKeyJWKUJBXQFRQPTO-UHFFFAOYSA-N
MW228.41 g/mol
LogP3.15
Rot. Bonds2

About cyclohexyl(dimethyl)silane;methyl prop-2-enoate

cyclohexyl(dimethyl)silane;methyl prop-2-enoate (PubChem CID 174610427) has the molecular formula C12H24O2Si and a molecular weight of 228.41 g/mol. Its IUPAC name is cyclohexyl(dimethyl)silane;methyl prop-2-enoate.

Molecular Properties

Compound Namecyclohexyl(dimethyl)silane;methyl prop-2-enoate
PubChem CID174610427
Molecular FormulaC12H24O2Si
Molecular Weight228.41 g/mol
Exact Mass228.15
IUPAC Namecyclohexyl(dimethyl)silane;methyl prop-2-enoate
SMILESC=CC(=O)OC.C[SiH](C)C1CCCCC1
InChIInChI=1S/C8H18Si.C4H6O2/c1-9(2)8-6-4-3-5-7-8;1-3-4(5)6-2/h8-9H,3-7H2,1-2H3;3H,1H2,2H3
InChIKeyJWKUJBXQFRQPTO-UHFFFAOYSA-N
XLogP3.15
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.41
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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

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CID 157183952
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CID 174735157
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CID 174834920
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CID 4205682
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CID 174920800
bis(methyl prop-2-enoate);propane
CID 160610529
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CID 174578648
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Frequently Asked Questions

What is the IUPAC name of cyclohexyl(dimethyl)silane;methyl prop-2-enoate?
The IUPAC name of cyclohexyl(dimethyl)silane;methyl prop-2-enoate (CID 174610427) is cyclohexyl(dimethyl)silane;methyl prop-2-enoate.
What is the SMILES notation for cyclohexyl(dimethyl)silane;methyl prop-2-enoate?
The canonical SMILES for cyclohexyl(dimethyl)silane;methyl prop-2-enoate is C=CC(=O)OC.C[SiH](C)C1CCCCC1.
What is the InChIKey of cyclohexyl(dimethyl)silane;methyl prop-2-enoate?
The InChIKey is JWKUJBXQFRQPTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18Si.C4H6O2/c1-9(2)8-6-4-3-5-7-8;1-3-4(5)6-2/h8-9H,3-7H2,1-2H3;3H,1H2,2H3.
What are the key properties of cyclohexyl(dimethyl)silane;methyl prop-2-enoate?
cyclohexyl(dimethyl)silane;methyl prop-2-enoate has a molecular weight of 228.41 g/mol, XLogP of 3.15, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl(dimethyl)silane;methyl prop-2-enoate is sourced from PubChem (CID 174610427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).