ethyl(dimethyl)stannane;methyl prop-2-enoate

C8H18O2Sn — CID 174264284

IUPACethyl(dimethyl)stannane;methyl prop-2-enoate
SMILESC=CC(=O)OC.CC[SnH](C)C
InChIInChI=1S/C4H6O2.C2H5.2CH3.Sn.H/c1-3-4(5)6-2;1-2;;;;/h3H,1H2,2H3;1H2,2H3;2*1H3;;
InChIKeySKUBLFHRPYOKDD-UHFFFAOYSA-N
MW264.94 g/mol
LogP1.84
Rot. Bonds2

About ethyl(dimethyl)stannane;methyl prop-2-enoate

ethyl(dimethyl)stannane;methyl prop-2-enoate (PubChem CID 174264284) has the molecular formula C8H18O2Sn and a molecular weight of 264.94 g/mol. Its IUPAC name is ethyl(dimethyl)stannane;methyl prop-2-enoate.

Molecular Properties

Compound Nameethyl(dimethyl)stannane;methyl prop-2-enoate
PubChem CID174264284
Molecular FormulaC8H18O2Sn
Molecular Weight264.94 g/mol
Exact Mass266.03
IUPAC Nameethyl(dimethyl)stannane;methyl prop-2-enoate
SMILESC=CC(=O)OC.CC[SnH](C)C
InChIInChI=1S/C4H6O2.C2H5.2CH3.Sn.H/c1-3-4(5)6-2;1-2;;;;/h3H,1H2,2H3;1H2,2H3;2*1H3;;
InChIKeySKUBLFHRPYOKDD-UHFFFAOYSA-N
XLogP1.84
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.94
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze ethyl(dimethyl)stannane;methyl prop-2-enoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

bis(methyl prop-2-enoate);propane
CID 160610529
formaldehyde;bis(methyl prop-2-enoate)
CID 174834920
N-methylmethanamine;methyl prop-2-enoate
CID 160519545
methyl prop-2-enoate;zinc;hydroiodide
CID 174920800
dimethoxymethane;methyl prop-2-enoate
CID 162245850
dimethyltin;methyl prop-2-enoate
CID 174578648
3-chloroprop-1-ene;methyl prop-2-enoate
CID 19001181
cyclobutane;methyl prop-2-enoate;hydrate
CID 157183952
chloroform;methyl prop-2-enoate
CID 123529405
methyl prop-2-enoate;sulfuric acid
CID 174506127
diiodolead;methyl prop-2-enoate
CID 175762695
benzene;ethene;methyl prop-2-enoate
CID 174897686

Frequently Asked Questions

What is the IUPAC name of ethyl(dimethyl)stannane;methyl prop-2-enoate?
The IUPAC name of ethyl(dimethyl)stannane;methyl prop-2-enoate (CID 174264284) is ethyl(dimethyl)stannane;methyl prop-2-enoate.
What is the SMILES notation for ethyl(dimethyl)stannane;methyl prop-2-enoate?
The canonical SMILES for ethyl(dimethyl)stannane;methyl prop-2-enoate is C=CC(=O)OC.CC[SnH](C)C.
What is the InChIKey of ethyl(dimethyl)stannane;methyl prop-2-enoate?
The InChIKey is SKUBLFHRPYOKDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6O2.C2H5.2CH3.Sn.H/c1-3-4(5)6-2;1-2;;;;/h3H,1H2,2H3;1H2,2H3;2*1H3;;.
What are the key properties of ethyl(dimethyl)stannane;methyl prop-2-enoate?
ethyl(dimethyl)stannane;methyl prop-2-enoate has a molecular weight of 264.94 g/mol, XLogP of 1.84, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl(dimethyl)stannane;methyl prop-2-enoate is sourced from PubChem (CID 174264284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).