1,1-dipropoxypropyl-dimethoxy-methylsilane

C12H28O4Si — CID 175337498

IUPAC1,1-dipropoxypropyl-dimethoxy-methylsilane
SMILESCCCOC(CC)(OCCC)[Si](C)(OC)OC
InChIInChI=1S/C12H28O4Si/c1-7-10-15-12(9-3,16-11-8-2)17(6,13-4)14-5/h7-11H2,1-6H3
InChIKeyXPARDTTVWGUTIW-UHFFFAOYSA-N
MW264.44 g/mol
LogP2.85
Rot. Bonds10

About 1,1-dipropoxypropyl-dimethoxy-methylsilane

1,1-dipropoxypropyl-dimethoxy-methylsilane (PubChem CID 175337498) has the molecular formula C12H28O4Si and a molecular weight of 264.44 g/mol. Its IUPAC name is 1,1-dipropoxypropyl-dimethoxy-methylsilane.

Molecular Properties

Compound Name1,1-dipropoxypropyl-dimethoxy-methylsilane
PubChem CID175337498
Molecular FormulaC12H28O4Si
Molecular Weight264.44 g/mol
Exact Mass264.18
IUPAC Name1,1-dipropoxypropyl-dimethoxy-methylsilane
SMILESCCCOC(CC)(OCCC)[Si](C)(OC)OC
InChIInChI=1S/C12H28O4Si/c1-7-10-15-12(9-3,16-11-8-2)17(6,13-4)14-5/h7-11H2,1-6H3
InChIKeyXPARDTTVWGUTIW-UHFFFAOYSA-N
XLogP2.85
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.44
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

methoxymethoxy-dimethyl-(3,3,3-tripropoxypropyl)silane
CID 175067938
methyl-(2-methylbutan-2-yl)-dipropoxysilane
CID 153327730
1-(1,1-dipropoxyethoxy)propane
CID 21433420
1,1-dichloro-1-propoxypropane
CID 87434594
1-methoxy-2-methyl-2-propoxybutane
CID 122692846
dimethoxy-methyl-[tris[dimethoxy(methyl)silyl]methyl]silane
CID 87831949
methane;tris(2-methyl-2-propoxypropane)
CID 160767059
3-[dimethoxy(methyl)silyl]-3-ethylpentan-1-amine
CID 54410640
1,1-dipropoxyethylsilane
CID 173115072
3-ethylpentan-3-yl-methoxy-dimethylsilane
CID 54356799
tert-butyl-dimethoxy-propoxysilane
CID 139714542
bis(2,2-dimethylpropane);ethane;methane;methoxy(trimethyl)silane;propane;tris(tetramethylsilane)
CID 164955269

Frequently Asked Questions

What is the IUPAC name of 1,1-dipropoxypropyl-dimethoxy-methylsilane?
The IUPAC name of 1,1-dipropoxypropyl-dimethoxy-methylsilane (CID 175337498) is 1,1-dipropoxypropyl-dimethoxy-methylsilane.
What is the SMILES notation for 1,1-dipropoxypropyl-dimethoxy-methylsilane?
The canonical SMILES for 1,1-dipropoxypropyl-dimethoxy-methylsilane is CCCOC(CC)(OCCC)[Si](C)(OC)OC.
What is the InChIKey of 1,1-dipropoxypropyl-dimethoxy-methylsilane?
The InChIKey is XPARDTTVWGUTIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28O4Si/c1-7-10-15-12(9-3,16-11-8-2)17(6,13-4)14-5/h7-11H2,1-6H3.
What are the key properties of 1,1-dipropoxypropyl-dimethoxy-methylsilane?
1,1-dipropoxypropyl-dimethoxy-methylsilane has a molecular weight of 264.44 g/mol, XLogP of 2.85, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dipropoxypropyl-dimethoxy-methylsilane is sourced from PubChem (CID 175337498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).