methyl-pent-4-enyl-di(propan-2-yloxy)silane

C12H26O2Si — CID 87359287

IUPACmethyl-pent-4-enyl-di(propan-2-yloxy)silane
SMILESC=CCCC[Si](C)(OC(C)C)OC(C)C
InChIInChI=1S/C12H26O2Si/c1-7-8-9-10-15(6,13-11(2)3)14-12(4)5/h7,11-12H,1,8-10H2,2-6H3
InChIKeyUTHVFGMTCNRBDI-UHFFFAOYSA-N
MW230.42 g/mol
LogP3.87
Rot. Bonds8

About methyl-pent-4-enyl-di(propan-2-yloxy)silane

methyl-pent-4-enyl-di(propan-2-yloxy)silane (PubChem CID 87359287) has the molecular formula C12H26O2Si and a molecular weight of 230.42 g/mol. Its IUPAC name is methyl-pent-4-enyl-di(propan-2-yloxy)silane.

Molecular Properties

Compound Namemethyl-pent-4-enyl-di(propan-2-yloxy)silane
PubChem CID87359287
Molecular FormulaC12H26O2Si
Molecular Weight230.42 g/mol
Exact Mass230.17
IUPAC Namemethyl-pent-4-enyl-di(propan-2-yloxy)silane
SMILESC=CCCC[Si](C)(OC(C)C)OC(C)C
InChIInChI=1S/C12H26O2Si/c1-7-8-9-10-15(6,13-11(2)3)14-12(4)5/h7,11-12H,1,8-10H2,2-6H3
InChIKeyUTHVFGMTCNRBDI-UHFFFAOYSA-N
XLogP3.87
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.42
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methyl-pent-4-enyl-di(propan-2-yloxy)silane?
The IUPAC name of methyl-pent-4-enyl-di(propan-2-yloxy)silane (CID 87359287) is methyl-pent-4-enyl-di(propan-2-yloxy)silane.
What is the SMILES notation for methyl-pent-4-enyl-di(propan-2-yloxy)silane?
The canonical SMILES for methyl-pent-4-enyl-di(propan-2-yloxy)silane is C=CCCC[Si](C)(OC(C)C)OC(C)C.
What is the InChIKey of methyl-pent-4-enyl-di(propan-2-yloxy)silane?
The InChIKey is UTHVFGMTCNRBDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26O2Si/c1-7-8-9-10-15(6,13-11(2)3)14-12(4)5/h7,11-12H,1,8-10H2,2-6H3.
What are the key properties of methyl-pent-4-enyl-di(propan-2-yloxy)silane?
methyl-pent-4-enyl-di(propan-2-yloxy)silane has a molecular weight of 230.42 g/mol, XLogP of 3.87, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-pent-4-enyl-di(propan-2-yloxy)silane is sourced from PubChem (CID 87359287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).