butoxy-(2,3-dimethylphenoxy)-dimethylsilane

C14H24O2Si — CID 91738660

IUPACbutoxy-(2,3-dimethylphenoxy)-dimethylsilane
SMILESCCCCO[Si](C)(C)Oc1cccc(C)c1C
InChIInChI=1S/C14H24O2Si/c1-6-7-11-15-17(4,5)16-14-10-8-9-12(2)13(14)3/h8-10H,6-7,11H2,1-5H3
InChIKeyYJKSZGQWCFFJAQ-UHFFFAOYSA-N
MW252.43 g/mol
LogP4.20
Rot. Bonds6

About butoxy-(2,3-dimethylphenoxy)-dimethylsilane

butoxy-(2,3-dimethylphenoxy)-dimethylsilane (PubChem CID 91738660) has the molecular formula C14H24O2Si and a molecular weight of 252.43 g/mol. Its IUPAC name is butoxy-(2,3-dimethylphenoxy)-dimethylsilane.

Molecular Properties

Compound Namebutoxy-(2,3-dimethylphenoxy)-dimethylsilane
PubChem CID91738660
Molecular FormulaC14H24O2Si
Molecular Weight252.43 g/mol
Exact Mass252.15
IUPAC Namebutoxy-(2,3-dimethylphenoxy)-dimethylsilane
SMILESCCCCO[Si](C)(C)Oc1cccc(C)c1C
InChIInChI=1S/C14H24O2Si/c1-6-7-11-15-17(4,5)16-14-10-8-9-12(2)13(14)3/h8-10H,6-7,11H2,1-5H3
InChIKeyYJKSZGQWCFFJAQ-UHFFFAOYSA-N
XLogP4.20
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.43
LogP ≤ 54.20
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'}

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Related Compounds

hexadecoxy-dimethyl-(2-methylphenoxy)silane
CID 91744863
butyl-(2,3-dimethylphenoxy)-dimethylsilane
CID 90427647
(2,6-dimethoxyphenoxy)-dimethyl-pentoxysilane
CID 91740000
(2-chlorophenoxy)-dimethyl-tetradecoxysilane
CID 91744415
dodecoxy-(2-fluorophenoxy)-dimethylsilane
CID 91743647
(2,5-dimethylphenoxy)-dimethyl-pentadecoxysilane
CID 91744864
dodecoxy-dimethyl-(2-phenylphenoxy)silane
CID 91744976
dimethyl-octoxy-(2-phenylphenoxy)silane
CID 91734404
1,3-dibutoxy-2-methylbenzene
CID 14475066
hexane;1,2,3-trimethylbenzene
CID 159405289
(2-chlorophenoxy)-[dimethyl(undecoxy)silyl]oxy-dimethylsilane
CID 91741759
dimethyl-octoxy-(4-phenylphenoxy)silane
CID 91743735

Frequently Asked Questions

What is the IUPAC name of butoxy-(2,3-dimethylphenoxy)-dimethylsilane?
The IUPAC name of butoxy-(2,3-dimethylphenoxy)-dimethylsilane (CID 91738660) is butoxy-(2,3-dimethylphenoxy)-dimethylsilane.
What is the SMILES notation for butoxy-(2,3-dimethylphenoxy)-dimethylsilane?
The canonical SMILES for butoxy-(2,3-dimethylphenoxy)-dimethylsilane is CCCCO[Si](C)(C)Oc1cccc(C)c1C.
What is the InChIKey of butoxy-(2,3-dimethylphenoxy)-dimethylsilane?
The InChIKey is YJKSZGQWCFFJAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O2Si/c1-6-7-11-15-17(4,5)16-14-10-8-9-12(2)13(14)3/h8-10H,6-7,11H2,1-5H3.
What are the key properties of butoxy-(2,3-dimethylphenoxy)-dimethylsilane?
butoxy-(2,3-dimethylphenoxy)-dimethylsilane has a molecular weight of 252.43 g/mol, XLogP of 4.20, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butoxy-(2,3-dimethylphenoxy)-dimethylsilane is sourced from PubChem (CID 91738660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).