triethoxy 3-hydroxypropyl silicate

C9H22O8Si — CID 174779946

IUPACtriethoxy 3-hydroxypropyl silicate
SMILESCCOO[Si](OCCCO)(OOCC)OOCC
InChIInChI=1S/C9H22O8Si/c1-4-11-15-18(16-12-5-2,17-13-6-3)14-9-7-8-10/h10H,4-9H2,1-3H3
InChIKeyLJJMTPWLGNWFGU-UHFFFAOYSA-N
MW286.35 g/mol
LogP0.73
Rot. Bonds13

About triethoxy 3-hydroxypropyl silicate

triethoxy 3-hydroxypropyl silicate (PubChem CID 174779946) has the molecular formula C9H22O8Si and a molecular weight of 286.35 g/mol. Its IUPAC name is triethoxy 3-hydroxypropyl silicate.

Molecular Properties

Compound Nametriethoxy 3-hydroxypropyl silicate
PubChem CID174779946
Molecular FormulaC9H22O8Si
Molecular Weight286.35 g/mol
Exact Mass286.11
IUPAC Nametriethoxy 3-hydroxypropyl silicate
SMILESCCOO[Si](OCCCO)(OOCC)OOCC
InChIInChI=1S/C9H22O8Si/c1-4-11-15-18(16-12-5-2,17-13-6-3)14-9-7-8-10/h10H,4-9H2,1-3H3
InChIKeyLJJMTPWLGNWFGU-UHFFFAOYSA-N
XLogP0.73
TPSA84.84 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds13
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.35
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

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Related Compounds

3-aminopropyl triethoxy silicate
CID 87731521
triethoxy propyl silicate
CID 174508791
methanol;tetraethoxy silicate
CID 131718397
tetraethoxy silicate;tetraethyl silicate
CID 174188107
3-chloropropyl diethoxy prop-2-enyl silicate
CID 174682643
3-[2-(3-ethoxypropoxy)ethoxy]propan-1-ol
CID 88558917
6-triethylsilyloxyhexan-1-ol
CID 86092423
ethenyl triethoxy silicate
CID 142721539
4-(2-ethoxyethoxy)butan-1-ol
CID 15885586
triethoxy (2-methylpropan-2-yl)oxy silicate
CID 174813265
bis(3-chloropropyl) diethyl silicate
CID 153327959
diethyl dioctyl silicate
CID 154218739

Frequently Asked Questions

What is the IUPAC name of triethoxy 3-hydroxypropyl silicate?
The IUPAC name of triethoxy 3-hydroxypropyl silicate (CID 174779946) is triethoxy 3-hydroxypropyl silicate.
What is the SMILES notation for triethoxy 3-hydroxypropyl silicate?
The canonical SMILES for triethoxy 3-hydroxypropyl silicate is CCOO[Si](OCCCO)(OOCC)OOCC.
What is the InChIKey of triethoxy 3-hydroxypropyl silicate?
The InChIKey is LJJMTPWLGNWFGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22O8Si/c1-4-11-15-18(16-12-5-2,17-13-6-3)14-9-7-8-10/h10H,4-9H2,1-3H3.
What are the key properties of triethoxy 3-hydroxypropyl silicate?
triethoxy 3-hydroxypropyl silicate has a molecular weight of 286.35 g/mol, XLogP of 0.73, 13 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy 3-hydroxypropyl silicate is sourced from PubChem (CID 174779946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).