butyl(1,1-dimethoxypropyl)silane

C9H22O2Si — CID 175005469

IUPACbutyl(1,1-dimethoxypropyl)silane
SMILESCCCC[SiH2]C(CC)(OC)OC
InChIInChI=1S/C9H22O2Si/c1-5-7-8-12-9(6-2,10-3)11-4/h5-8,12H2,1-4H3
InChIKeyYQXQNBVMVUFGQN-UHFFFAOYSA-N
MW190.36 g/mol
LogP1.73
Rot. Bonds7

About butyl(1,1-dimethoxypropyl)silane

butyl(1,1-dimethoxypropyl)silane (PubChem CID 175005469) has the molecular formula C9H22O2Si and a molecular weight of 190.36 g/mol. Its IUPAC name is butyl(1,1-dimethoxypropyl)silane.

Molecular Properties

Compound Namebutyl(1,1-dimethoxypropyl)silane
PubChem CID175005469
Molecular FormulaC9H22O2Si
Molecular Weight190.36 g/mol
Exact Mass190.14
IUPAC Namebutyl(1,1-dimethoxypropyl)silane
SMILESCCCC[SiH2]C(CC)(OC)OC
InChIInChI=1S/C9H22O2Si/c1-5-7-8-12-9(6-2,10-3)11-4/h5-8,12H2,1-4H3
InChIKeyYQXQNBVMVUFGQN-UHFFFAOYSA-N
XLogP1.73
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.36
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,1-dimethoxypropyl(hexyl)silane
CID 175001852
1,1-dimethoxypropyl(ethyl)silane
CID 159440115
butyl(trifluoromethyl)silane
CID 123810113
butyl(3-butylsilylpropyl)silane
CID 123413322
dibutylsilane;hydrofluoride
CID 174699243
butyl(2-tert-butylsilylethyl)silane
CID 150716320
2-methoxy-2-methylpropane;pentane
CID 22145886
2,2,2-trimethoxyethanol;zirconium
CID 87320991
1,1-dimethoxyethyl-[4-(1,1-dimethoxyethylsilyl)butyl]silane
CID 173017003
2-butyl-2-methoxypropanedial
CID 141040124
1,1,2,2-tetramethoxyoctane
CID 15697911
4,4-dimethoxy-5-propyltridecane
CID 151317508

Frequently Asked Questions

What is the IUPAC name of butyl(1,1-dimethoxypropyl)silane?
The IUPAC name of butyl(1,1-dimethoxypropyl)silane (CID 175005469) is butyl(1,1-dimethoxypropyl)silane.
What is the SMILES notation for butyl(1,1-dimethoxypropyl)silane?
The canonical SMILES for butyl(1,1-dimethoxypropyl)silane is CCCC[SiH2]C(CC)(OC)OC.
What is the InChIKey of butyl(1,1-dimethoxypropyl)silane?
The InChIKey is YQXQNBVMVUFGQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22O2Si/c1-5-7-8-12-9(6-2,10-3)11-4/h5-8,12H2,1-4H3.
What are the key properties of butyl(1,1-dimethoxypropyl)silane?
butyl(1,1-dimethoxypropyl)silane has a molecular weight of 190.36 g/mol, XLogP of 1.73, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butyl(1,1-dimethoxypropyl)silane is sourced from PubChem (CID 175005469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).