hydroxy-dimethyl-(2-methyl-1-pent-4-en-2-yloxypropyl)silane

C11H24O2Si — CID 10703963

IUPAChydroxy-dimethyl-(2-methyl-1-pent-4-en-2-yloxypropyl)silane
SMILESC=CCC(C)OC(C(C)C)[Si](C)(C)O
InChIInChI=1S/C11H24O2Si/c1-7-8-10(4)13-11(9(2)3)14(5,6)12/h7,9-12H,1,8H2,2-6H3
InChIKeyKNVPPYDQTXGPFT-UHFFFAOYSA-N
MW216.40 g/mol
LogP2.73
Rot. Bonds6

About hydroxy-dimethyl-(2-methyl-1-pent-4-en-2-yloxypropyl)silane

hydroxy-dimethyl-(2-methyl-1-pent-4-en-2-yloxypropyl)silane (PubChem CID 10703963) has the molecular formula C11H24O2Si and a molecular weight of 216.40 g/mol. Its IUPAC name is hydroxy-dimethyl-(2-methyl-1-pent-4-en-2-yloxypropyl)silane.

Molecular Properties

Compound Namehydroxy-dimethyl-(2-methyl-1-pent-4-en-2-yloxypropyl)silane
PubChem CID10703963
Molecular FormulaC11H24O2Si
Molecular Weight216.40 g/mol
Exact Mass216.15
IUPAC Namehydroxy-dimethyl-(2-methyl-1-pent-4-en-2-yloxypropyl)silane
SMILESC=CCC(C)OC(C(C)C)[Si](C)(C)O
InChIInChI=1S/C11H24O2Si/c1-7-8-10(4)13-11(9(2)3)14(5,6)12/h7,9-12H,1,8H2,2-6H3
InChIKeyKNVPPYDQTXGPFT-UHFFFAOYSA-N
XLogP2.73
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.40
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'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 hydroxy-dimethyl-(2-methyl-1-pent-4-en-2-yloxypropyl)silane?
The IUPAC name of hydroxy-dimethyl-(2-methyl-1-pent-4-en-2-yloxypropyl)silane (CID 10703963) is hydroxy-dimethyl-(2-methyl-1-pent-4-en-2-yloxypropyl)silane.
What is the SMILES notation for hydroxy-dimethyl-(2-methyl-1-pent-4-en-2-yloxypropyl)silane?
The canonical SMILES for hydroxy-dimethyl-(2-methyl-1-pent-4-en-2-yloxypropyl)silane is C=CCC(C)OC(C(C)C)[Si](C)(C)O.
What is the InChIKey of hydroxy-dimethyl-(2-methyl-1-pent-4-en-2-yloxypropyl)silane?
The InChIKey is KNVPPYDQTXGPFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O2Si/c1-7-8-10(4)13-11(9(2)3)14(5,6)12/h7,9-12H,1,8H2,2-6H3.
What are the key properties of hydroxy-dimethyl-(2-methyl-1-pent-4-en-2-yloxypropyl)silane?
hydroxy-dimethyl-(2-methyl-1-pent-4-en-2-yloxypropyl)silane has a molecular weight of 216.40 g/mol, XLogP of 2.73, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-dimethyl-(2-methyl-1-pent-4-en-2-yloxypropyl)silane is sourced from PubChem (CID 10703963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).