dihydroxy-methyl-octylsilane

C9H22O2Si — CID 23505374

IUPACdihydroxy-methyl-octylsilane
SMILESCCCCCCCC[Si](C)(O)O
InChIInChI=1S/C9H22O2Si/c1-3-4-5-6-7-8-9-12(2,10)11/h10-11H,3-9H2,1-2H3
InChIKeyRPBRAWNJMIMKAH-UHFFFAOYSA-N
MW190.36 g/mol
LogP2.40
Rot. Bonds7

About dihydroxy-methyl-octylsilane

dihydroxy-methyl-octylsilane (PubChem CID 23505374) has the molecular formula C9H22O2Si and a molecular weight of 190.36 g/mol. Its IUPAC name is dihydroxy-methyl-octylsilane.

Molecular Properties

Compound Namedihydroxy-methyl-octylsilane
PubChem CID23505374
Molecular FormulaC9H22O2Si
Molecular Weight190.36 g/mol
Exact Mass190.14
IUPAC Namedihydroxy-methyl-octylsilane
SMILESCCCCCCCC[Si](C)(O)O
InChIInChI=1S/C9H22O2Si/c1-3-4-5-6-7-8-9-12(2,10)11/h10-11H,3-9H2,1-2H3
InChIKeyRPBRAWNJMIMKAH-UHFFFAOYSA-N
XLogP2.40
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.36
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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

Caprylyl trisiloxane
CID 87373
Silane, chlorodimethyloctyl-, hydrolysis products with silica
CID 172252
Dimethoxymethyloctylsilane
CID 4178497
Myristyl trisiloxane
CID 71356150
Siliclad
CID 22483723
3-Hexadecyl-1,1,1,3,5,5,5-heptamethyltrisiloxane
CID 71356149
Octadecyldimethylsilanol
CID 11198256
Stearyl trisiloxane
CID 18674845
Dodecylheptamethyltrisiloxane
CID 53436584
Poly(methyltetradecylsiloxane)
CID 165358928
Trisiloxane, 3-decyl-1,1,1,3,5,5,5-heptamethyl-
CID 10155580
Silanetriol, octyl-
CID 11564621

Frequently Asked Questions

What is the IUPAC name of dihydroxy-methyl-octylsilane?
The IUPAC name of dihydroxy-methyl-octylsilane (CID 23505374) is dihydroxy-methyl-octylsilane.
What is the SMILES notation for dihydroxy-methyl-octylsilane?
The canonical SMILES for dihydroxy-methyl-octylsilane is CCCCCCCC[Si](C)(O)O.
What is the InChIKey of dihydroxy-methyl-octylsilane?
The InChIKey is RPBRAWNJMIMKAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22O2Si/c1-3-4-5-6-7-8-9-12(2,10)11/h10-11H,3-9H2,1-2H3.
What are the key properties of dihydroxy-methyl-octylsilane?
dihydroxy-methyl-octylsilane has a molecular weight of 190.36 g/mol, XLogP of 2.40, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dihydroxy-methyl-octylsilane is sourced from PubChem (CID 23505374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).