diethoxy(1-propoxypropyl)silane;hydrate

C10H26O4Si — CID 174935821

IUPACdiethoxy(1-propoxypropyl)silane;hydrate
SMILESCCCOC(CC)[SiH](OCC)OCC.O
InChIInChI=1S/C10H24O3Si.H2O/c1-5-9-11-10(6-2)14(12-7-3)13-8-4;/h10,14H,5-9H2,1-4H3;1H2
InChIKeyLJAGCMLIKKLICN-UHFFFAOYSA-N
MW238.40 g/mol
LogP1.20
Rot. Bonds9

About diethoxy(1-propoxypropyl)silane;hydrate

diethoxy(1-propoxypropyl)silane;hydrate (PubChem CID 174935821) has the molecular formula C10H26O4Si and a molecular weight of 238.40 g/mol. Its IUPAC name is diethoxy(1-propoxypropyl)silane;hydrate.

Molecular Properties

Compound Namediethoxy(1-propoxypropyl)silane;hydrate
PubChem CID174935821
Molecular FormulaC10H26O4Si
Molecular Weight238.40 g/mol
Exact Mass238.16
IUPAC Namediethoxy(1-propoxypropyl)silane;hydrate
SMILESCCCOC(CC)[SiH](OCC)OCC.O
InChIInChI=1S/C10H24O3Si.H2O/c1-5-9-11-10(6-2)14(12-7-3)13-8-4;/h10,14H,5-9H2,1-4H3;1H2
InChIKeyLJAGCMLIKKLICN-UHFFFAOYSA-N
XLogP1.20
TPSA59.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.40
LogP ≤ 51.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(oxiran-2-ylmethoxy)propyl-dipropoxysilane
CID 123534416
diethoxy-[oxiran-2-yl(propoxy)methyl]silane
CID 175581697
diethoxy-[1-(2-methylprop-2-enoxy)butyl]silane
CID 172997108
1-propoxypropan-1-ol;hydrate
CID 174406445
diethoxy-[1-(oxiran-2-ylmethoxy)pentyl]silane
CID 173177487
(2R,3R)-2,3-dipropoxybutane
CID 118445331
1-propoxypropane-1-thiol
CID 57215222
1-propoxypropan-1-amine;1-propoxypropane;hydrate
CID 88800294
1-methoxy-1-propoxypropane
CID 19963975
ethoxy-diethyl-propoxyphosphanium
CID 138521190
1-diethoxysilyl-N,N-diethoxypropan-1-amine
CID 173020312
1-diethoxysilylbutyl 2-methylprop-2-enoate
CID 123755073

Frequently Asked Questions

What is the IUPAC name of diethoxy(1-propoxypropyl)silane;hydrate?
The IUPAC name of diethoxy(1-propoxypropyl)silane;hydrate (CID 174935821) is diethoxy(1-propoxypropyl)silane;hydrate.
What is the SMILES notation for diethoxy(1-propoxypropyl)silane;hydrate?
The canonical SMILES for diethoxy(1-propoxypropyl)silane;hydrate is CCCOC(CC)[SiH](OCC)OCC.O.
What is the InChIKey of diethoxy(1-propoxypropyl)silane;hydrate?
The InChIKey is LJAGCMLIKKLICN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24O3Si.H2O/c1-5-9-11-10(6-2)14(12-7-3)13-8-4;/h10,14H,5-9H2,1-4H3;1H2.
What are the key properties of diethoxy(1-propoxypropyl)silane;hydrate?
diethoxy(1-propoxypropyl)silane;hydrate has a molecular weight of 238.40 g/mol, XLogP of 1.20, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy(1-propoxypropyl)silane;hydrate is sourced from PubChem (CID 174935821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).