(3-ethyl-3-propylheptoxy)silane

C12H28OSi — CID 123804665

IUPAC(3-ethyl-3-propylheptoxy)silane
SMILESCCCCC(CC)(CCC)CCO[SiH3]
InChIInChI=1S/C12H28OSi/c1-4-7-9-12(6-3,8-5-2)10-11-13-14/h4-11H2,1-3,14H3
InChIKeyOSIAIDUDQOSGBL-UHFFFAOYSA-N
MW216.44 g/mol
LogP3.06
Rot. Bonds9

About (3-ethyl-3-propylheptoxy)silane

(3-ethyl-3-propylheptoxy)silane (PubChem CID 123804665) has the molecular formula C12H28OSi and a molecular weight of 216.44 g/mol. Its IUPAC name is (3-ethyl-3-propylheptoxy)silane.

Molecular Properties

Compound Name(3-ethyl-3-propylheptoxy)silane
PubChem CID123804665
Molecular FormulaC12H28OSi
Molecular Weight216.44 g/mol
Exact Mass216.19
IUPAC Name(3-ethyl-3-propylheptoxy)silane
SMILESCCCCC(CC)(CCC)CCO[SiH3]
InChIInChI=1S/C12H28OSi/c1-4-7-9-12(6-3,8-5-2)10-11-13-14/h4-11H2,1-3,14H3
InChIKeyOSIAIDUDQOSGBL-UHFFFAOYSA-N
XLogP3.06
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.44
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3,3-dipropylhexoxysilane
CID 123559989
4,4-diethylhexoxysilane
CID 123746952
4,4-diethyloctane;ethane
CID 177031380
7-butyl-7-ethyltetradecane
CID 174665936
5,8-dibutyl-5,8-diethyldodecane
CID 140960006
2,2-dibutylhexoxysilane
CID 123695436
4,4,9,9-tetrapropyldodecane
CID 140610407
2,2-dipropylhexan-1-ol;2-ethyl-2-propylhexan-1-ol
CID 23057811
(3-ethenyl-3-propylheptoxy)silane
CID 123652924
4-ethyl-4-(2-methylbutan-2-yloxymethyl)octane
CID 123648413
5-(bromomethyl)-5-ethyldecane
CID 66050234
3,3-diethylheptane;3,3-diethylhexane;3,3-diethylpentane;3-ethylpentane;methane
CID 158847825

Frequently Asked Questions

What is the IUPAC name of (3-ethyl-3-propylheptoxy)silane?
The IUPAC name of (3-ethyl-3-propylheptoxy)silane (CID 123804665) is (3-ethyl-3-propylheptoxy)silane.
What is the SMILES notation for (3-ethyl-3-propylheptoxy)silane?
The canonical SMILES for (3-ethyl-3-propylheptoxy)silane is CCCCC(CC)(CCC)CCO[SiH3].
What is the InChIKey of (3-ethyl-3-propylheptoxy)silane?
The InChIKey is OSIAIDUDQOSGBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28OSi/c1-4-7-9-12(6-3,8-5-2)10-11-13-14/h4-11H2,1-3,14H3.
What are the key properties of (3-ethyl-3-propylheptoxy)silane?
(3-ethyl-3-propylheptoxy)silane has a molecular weight of 216.44 g/mol, XLogP of 3.06, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethyl-3-propylheptoxy)silane is sourced from PubChem (CID 123804665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).