2-undecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane

C11H32O5Si5 — CID 173048202

IUPAC2-undecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane
SMILESCCCCCCCCCCC[SiH]1O[SiH2]O[SiH2]O[SiH2]O[SiH2]O1
InChIInChI=1S/C11H32O5Si5/c1-2-3-4-5-6-7-8-9-10-11-21-15-19-13-17-12-18-14-20-16-21/h21H,2-11,17-20H2,1H3
InChIKeyYBCJQBQULGFBRI-UHFFFAOYSA-N
MW384.80 g/mol
LogP-0.17
Rot. Bonds10

About 2-undecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane

2-undecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane (PubChem CID 173048202) has the molecular formula C11H32O5Si5 and a molecular weight of 384.80 g/mol. Its IUPAC name is 2-undecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane.

Molecular Properties

Compound Name2-undecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane
PubChem CID173048202
Molecular FormulaC11H32O5Si5
Molecular Weight384.80 g/mol
Exact Mass384.11
IUPAC Name2-undecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane
SMILESCCCCCCCCCCC[SiH]1O[SiH2]O[SiH2]O[SiH2]O[SiH2]O1
InChIInChI=1S/C11H32O5Si5/c1-2-3-4-5-6-7-8-9-10-11-21-15-19-13-17-12-18-14-20-16-21/h21H,2-11,17-20H2,1H3
InChIKeyYBCJQBQULGFBRI-UHFFFAOYSA-N
XLogP-0.17
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.80
LogP ≤ 5-0.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-hexyldioxasilirane
CID 123402842
undecane;dihydrobromide
CID 172838591
azane;bis(octadecane);hydrobromide
CID 174053735
icosane;phosphane;hydrobromide
CID 172836983
(1,2,3,4,5,6,7,8,9,10,11,12-13C12)dodecane
CID 71309250
dodecane;pentadecane
CID 162065772
dohexacontane
CID 522644
decane;heptane
CID 159049036
hexadecane;pentadecane
CID 159687875
dooctacontane
CID 522649
henoctacontane
CID 22086342
CID 161246447
CID 161246447

Frequently Asked Questions

What is the IUPAC name of 2-undecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane?
The IUPAC name of 2-undecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane (CID 173048202) is 2-undecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane.
What is the SMILES notation for 2-undecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane?
The canonical SMILES for 2-undecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane is CCCCCCCCCCC[SiH]1O[SiH2]O[SiH2]O[SiH2]O[SiH2]O1.
What is the InChIKey of 2-undecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane?
The InChIKey is YBCJQBQULGFBRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H32O5Si5/c1-2-3-4-5-6-7-8-9-10-11-21-15-19-13-17-12-18-14-20-16-21/h21H,2-11,17-20H2,1H3.
What are the key properties of 2-undecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane?
2-undecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane has a molecular weight of 384.80 g/mol, XLogP of -0.17, 10 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-undecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane is sourced from PubChem (CID 173048202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).