3-methylheptan-4-yloxysilane

C8H20OSi — CID 173078778

IUPAC3-methylheptan-4-yloxysilane
SMILESCCCC(O[SiH3])C(C)CC
InChIInChI=1S/C8H20OSi/c1-4-6-8(9-10)7(3)5-2/h7-8H,4-6H2,1-3,10H3
InChIKeyLLEOPDOJAOWVIX-UHFFFAOYSA-N
MW160.33 g/mol
LogP1.50
Rot. Bonds5

About 3-methylheptan-4-yloxysilane

3-methylheptan-4-yloxysilane (PubChem CID 173078778) has the molecular formula C8H20OSi and a molecular weight of 160.33 g/mol. Its IUPAC name is 3-methylheptan-4-yloxysilane.

Molecular Properties

Compound Name3-methylheptan-4-yloxysilane
PubChem CID173078778
Molecular FormulaC8H20OSi
Molecular Weight160.33 g/mol
Exact Mass160.13
IUPAC Name3-methylheptan-4-yloxysilane
SMILESCCCC(O[SiH3])C(C)CC
InChIInChI=1S/C8H20OSi/c1-4-6-8(9-10)7(3)5-2/h7-8H,4-6H2,1-3,10H3
InChIKeyLLEOPDOJAOWVIX-UHFFFAOYSA-N
XLogP1.50
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.33
LogP ≤ 51.50
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

5-butylnonan-4-yloxysilane
CID 173017008
(3R)-3,4-dimethylheptane
CID 59819300
bis(2,3-dimethylpentane);ethane;bis(2-methylbutane);bis(2-methylpentane)
CID 160533172
3,4,6,7-tetramethyl-5-propylnonane
CID 91018101
3-methoxy-2-methylhexane
CID 23384964
3-methylheptan-4-ylphosphane
CID 178108210
(3-butan-2-yl-4-methylhexan-2-yl)oxysilane
CID 173036864
4-chloro-3-methylheptane
CID 54215050
(4S)-3-methyl-4-propan-2-ylheptane
CID 59076556
4,5-dimethyloctoxysilane
CID 174499680
4,5-diethyloctane
CID 519254
methane;(3S,4R)-3-methyl-4-propan-2-ylheptane
CID 159506310

Frequently Asked Questions

What is the IUPAC name of 3-methylheptan-4-yloxysilane?
The IUPAC name of 3-methylheptan-4-yloxysilane (CID 173078778) is 3-methylheptan-4-yloxysilane.
What is the SMILES notation for 3-methylheptan-4-yloxysilane?
The canonical SMILES for 3-methylheptan-4-yloxysilane is CCCC(O[SiH3])C(C)CC.
What is the InChIKey of 3-methylheptan-4-yloxysilane?
The InChIKey is LLEOPDOJAOWVIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20OSi/c1-4-6-8(9-10)7(3)5-2/h7-8H,4-6H2,1-3,10H3.
What are the key properties of 3-methylheptan-4-yloxysilane?
3-methylheptan-4-yloxysilane has a molecular weight of 160.33 g/mol, XLogP of 1.50, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylheptan-4-yloxysilane is sourced from PubChem (CID 173078778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).