dimethyl dipropyl silicate;hydrate

C8H22O5Si — CID 174450535

IUPACdimethyl dipropyl silicate;hydrate
SMILESCCCO[Si](OC)(OC)OCCC.O
InChIInChI=1S/C8H20O4Si.H2O/c1-5-7-11-13(9-3,10-4)12-8-6-2;/h5-8H2,1-4H3;1H2
InChIKeyKGHSRMJOZRBPSE-UHFFFAOYSA-N
MW226.34 g/mol
LogP0.74
Rot. Bonds8

About dimethyl dipropyl silicate;hydrate

dimethyl dipropyl silicate;hydrate (PubChem CID 174450535) has the molecular formula C8H22O5Si and a molecular weight of 226.34 g/mol. Its IUPAC name is dimethyl dipropyl silicate;hydrate.

Molecular Properties

Compound Namedimethyl dipropyl silicate;hydrate
PubChem CID174450535
Molecular FormulaC8H22O5Si
Molecular Weight226.34 g/mol
Exact Mass226.12
IUPAC Namedimethyl dipropyl silicate;hydrate
SMILESCCCO[Si](OC)(OC)OCCC.O
InChIInChI=1S/C8H20O4Si.H2O/c1-5-7-11-13(9-3,10-4)12-8-6-2;/h5-8H2,1-4H3;1H2
InChIKeyKGHSRMJOZRBPSE-UHFFFAOYSA-N
XLogP0.74
TPSA68.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.34
LogP ≤ 50.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

dimethyl pentyl propyl silicate
CID 524721
3-[butoxy(dimethoxy)silyl]oxypropyl butyl dimethyl silicate
CID 141205267
dimethyl propan-2-yl propyl silicate
CID 18339322
ditert-butyl dimethyl silicate;methyl tripropyl silicate
CID 87785051
ethyl dimethyl pentyl silicate
CID 88851017
methyl tripentyl silicate
CID 524731
bis(2-fluoroethyl) dimethyl silicate
CID 20577556
methyl(tripropoxy)silane;hydrate
CID 172826593
tetrapropyl silicate;trimethyl(trimethylsilyloxy)silane
CID 87590627
dipentyl dipropyl silicate
CID 524722
CID 22613585
CID 22613585
2-ethoxyethyl trimethyl silicate
CID 141160179

Frequently Asked Questions

What is the IUPAC name of dimethyl dipropyl silicate;hydrate?
The IUPAC name of dimethyl dipropyl silicate;hydrate (CID 174450535) is dimethyl dipropyl silicate;hydrate.
What is the SMILES notation for dimethyl dipropyl silicate;hydrate?
The canonical SMILES for dimethyl dipropyl silicate;hydrate is CCCO[Si](OC)(OC)OCCC.O.
What is the InChIKey of dimethyl dipropyl silicate;hydrate?
The InChIKey is KGHSRMJOZRBPSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20O4Si.H2O/c1-5-7-11-13(9-3,10-4)12-8-6-2;/h5-8H2,1-4H3;1H2.
What are the key properties of dimethyl dipropyl silicate;hydrate?
dimethyl dipropyl silicate;hydrate has a molecular weight of 226.34 g/mol, XLogP of 0.74, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl dipropyl silicate;hydrate is sourced from PubChem (CID 174450535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).