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

C23H56O5Si5 — CID 123929311

IUPAC2,4,6,8,10-pentamethyl-2-octadecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane
SMILESCCCCCCCCCCCCCCCCCC[Si]1(C)O[SiH](C)O[SiH](C)O[SiH](C)O[SiH](C)O1
InChIInChI=1S/C23H56O5Si5/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-33(6)27-31(4)25-29(2)24-30(3)26-32(5)28-33/h29-32H,7-23H2,1-6H3
InChIKeyNUUIHBVQKCTMNS-UHFFFAOYSA-N
MW553.13 g/mol
LogP6.82
Rot. Bonds17

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

2,4,6,8,10-pentamethyl-2-octadecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane (PubChem CID 123929311) has the molecular formula C23H56O5Si5 and a molecular weight of 553.13 g/mol. Its IUPAC name is 2,4,6,8,10-pentamethyl-2-octadecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane.

Molecular Properties

Compound Name2,4,6,8,10-pentamethyl-2-octadecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane
PubChem CID123929311
Molecular FormulaC23H56O5Si5
Molecular Weight553.13 g/mol
Exact Mass552.30
IUPAC Name2,4,6,8,10-pentamethyl-2-octadecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane
SMILESCCCCCCCCCCCCCCCCCC[Si]1(C)O[SiH](C)O[SiH](C)O[SiH](C)O[SiH](C)O1
InChIInChI=1S/C23H56O5Si5/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-33(6)27-31(4)25-29(2)24-30(3)26-32(5)28-33/h29-32H,7-23H2,1-6H3
InChIKeyNUUIHBVQKCTMNS-UHFFFAOYSA-N
XLogP6.82
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds17
Heavy Atoms33
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500553.13
LogP ≤ 56.82
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'}

Analyze 2,4,6,8,10-pentamethyl-2-octadecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane with MolForge

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Launch Full Analysis

Related Compounds

2-(3-chloropropyl)-2,4,6-trimethyl-1,3,5,2,4,6-trioxatrisilinane
CID 175167484
2-(3-methoxypropyl)-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
CID 59622480
3-methyl-3-undecyldioxasilirane
CID 175063520
2,4,6,8-tetramethyl-2,4,6,8-tetrapentyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
CID 142697059
2-ethyl-2,4,6-trimethyl-1,3,5,2,4,6-trioxatrisilinane
CID 151551025
2,4,6,8-tetramethyl-2,4,6-trioctyl-8-propyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
CID 58021544
2,4,6,8-tetramethyl-2-(3,3,3-trifluoropropyl)-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
CID 154128105
2,4,6-trimethyl-2-(3,3,3-trichloropropyl)-1,3,5,2,4,6-trioxatrisilinane
CID 150465628
1-[2-(2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)ethoxy]propan-2-ol
CID 123280825
2-butyl-2,4,4,6,6,8,8-heptamethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane;2-butyl-2,4,4,6,6,8,8,10,10-nonamethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane;2-butyl-2,4,4,6,6-pentamethyl-1,3,5,2,4,6-trioxatrisilinane
CID 158551467
2,2,4,6,8,10-hexamethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane
CID 176847521
2-chloro-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
CID 154027680

Frequently Asked Questions

What is the IUPAC name of 2,4,6,8,10-pentamethyl-2-octadecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane?
The IUPAC name of 2,4,6,8,10-pentamethyl-2-octadecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane (CID 123929311) is 2,4,6,8,10-pentamethyl-2-octadecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane.
What is the SMILES notation for 2,4,6,8,10-pentamethyl-2-octadecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane?
The canonical SMILES for 2,4,6,8,10-pentamethyl-2-octadecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane is CCCCCCCCCCCCCCCCCC[Si]1(C)O[SiH](C)O[SiH](C)O[SiH](C)O[SiH](C)O1.
What is the InChIKey of 2,4,6,8,10-pentamethyl-2-octadecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane?
The InChIKey is NUUIHBVQKCTMNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H56O5Si5/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-33(6)27-31(4)25-29(2)24-30(3)26-32(5)28-33/h29-32H,7-23H2,1-6H3.
What are the key properties of 2,4,6,8,10-pentamethyl-2-octadecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane?
2,4,6,8,10-pentamethyl-2-octadecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane has a molecular weight of 553.13 g/mol, XLogP of 6.82, 17 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6,8,10-pentamethyl-2-octadecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane is sourced from PubChem (CID 123929311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).