trihydroxy(4-methylhexoxy)silane

C7H18O4Si — CID 88638969

IUPACtrihydroxy(4-methylhexoxy)silane
SMILESCCC(C)CCCO[Si](O)(O)O
InChIInChI=1S/C7H18O4Si/c1-3-7(2)5-4-6-11-12(8,9)10/h7-10H,3-6H2,1-2H3
InChIKeyIQFZFTIFVNKHSC-UHFFFAOYSA-N
MW194.30 g/mol
LogP0.24
Rot. Bonds6

About trihydroxy(4-methylhexoxy)silane

trihydroxy(4-methylhexoxy)silane (PubChem CID 88638969) has the molecular formula C7H18O4Si and a molecular weight of 194.30 g/mol. Its IUPAC name is trihydroxy(4-methylhexoxy)silane.

Molecular Properties

Compound Nametrihydroxy(4-methylhexoxy)silane
PubChem CID88638969
Molecular FormulaC7H18O4Si
Molecular Weight194.30 g/mol
Exact Mass194.10
IUPAC Nametrihydroxy(4-methylhexoxy)silane
SMILESCCC(C)CCCO[Si](O)(O)O
InChIInChI=1S/C7H18O4Si/c1-3-7(2)5-4-6-11-12(8,9)10/h7-10H,3-6H2,1-2H3
InChIKeyIQFZFTIFVNKHSC-UHFFFAOYSA-N
XLogP0.24
TPSA69.92 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.30
LogP ≤ 50.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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

trimethyl(20-methyldocosoxy)silane
CID 526068
trimethyl(22-methyltetracosoxy)silane
CID 91745133
(3R,7R)-3,7-dimethylnonane
CID 42626759
tert-butyl-dimethyl-(13-methylpentadecoxy)silane
CID 6430276
trihydroxy(tetradecoxy)silane
CID 87382904
1-methoxy-2,22-dimethyltetracosane
CID 86173032
[(4S)-4-methylhexyl] methanesulfonate
CID 57146796
1-hexan-3-yloxy-4-methylhexane
CID 142047921
tris(5-methylheptyl) phosphate
CID 87189340
[(4S)-4-methylhexyl] prop-2-ynoate
CID 101018981
4-methylhexyl prop-2-enoate
CID 58980362
3-methylheptane;nickel
CID 158967838

Frequently Asked Questions

What is the IUPAC name of trihydroxy(4-methylhexoxy)silane?
The IUPAC name of trihydroxy(4-methylhexoxy)silane (CID 88638969) is trihydroxy(4-methylhexoxy)silane.
What is the SMILES notation for trihydroxy(4-methylhexoxy)silane?
The canonical SMILES for trihydroxy(4-methylhexoxy)silane is CCC(C)CCCO[Si](O)(O)O.
What is the InChIKey of trihydroxy(4-methylhexoxy)silane?
The InChIKey is IQFZFTIFVNKHSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18O4Si/c1-3-7(2)5-4-6-11-12(8,9)10/h7-10H,3-6H2,1-2H3.
What are the key properties of trihydroxy(4-methylhexoxy)silane?
trihydroxy(4-methylhexoxy)silane has a molecular weight of 194.30 g/mol, XLogP of 0.24, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for trihydroxy(4-methylhexoxy)silane is sourced from PubChem (CID 88638969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).