hexoxy-dimethyl-(3-methylbut-3-enoxy)silane

C13H28O2Si — CID 91730344

IUPAChexoxy-dimethyl-(3-methylbut-3-enoxy)silane
SMILESC=C(C)CCO[Si](C)(C)OCCCCCC
InChIInChI=1S/C13H28O2Si/c1-6-7-8-9-11-14-16(4,5)15-12-10-13(2)3/h2,6-12H2,1,3-5H3
InChIKeyVNXRZQHUJPNVRU-UHFFFAOYSA-N
MW244.45 g/mol
LogP4.27
Rot. Bonds10

About hexoxy-dimethyl-(3-methylbut-3-enoxy)silane

hexoxy-dimethyl-(3-methylbut-3-enoxy)silane (PubChem CID 91730344) has the molecular formula C13H28O2Si and a molecular weight of 244.45 g/mol. Its IUPAC name is hexoxy-dimethyl-(3-methylbut-3-enoxy)silane.

Molecular Properties

Compound Namehexoxy-dimethyl-(3-methylbut-3-enoxy)silane
PubChem CID91730344
Molecular FormulaC13H28O2Si
Molecular Weight244.45 g/mol
Exact Mass244.19
IUPAC Namehexoxy-dimethyl-(3-methylbut-3-enoxy)silane
SMILESC=C(C)CCO[Si](C)(C)OCCCCCC
InChIInChI=1S/C13H28O2Si/c1-6-7-8-9-11-14-16(4,5)15-12-10-13(2)3/h2,6-12H2,1,3-5H3
InChIKeyVNXRZQHUJPNVRU-UHFFFAOYSA-N
XLogP4.27
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.45
LogP ≤ 54.27
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': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

3-Methyl-3-buten-1-ol, TMS derivative
CID 11367158
Silane, dimethyl(3-methylbut-3-enyloxy)isohexyloxy-
CID 91698239
Dimethylpyrrolbis[(3-methylbut-3-en-1-yl)oxy]morphosilane
CID 91717992
Silane, dimethyl(3-methylbut-3-enyloxy)propoxy-
CID 91719387
Silane, dimethyl(3-methylbut-3-enyloxy)isobutoxy-
CID 91723647
Silane, dimethyl(3-methylbut-3-enyloxy)butoxy-
CID 91723701
Silane, dimethyl(3-methylbut-3-enyloxy)pentyloxy-
CID 91726713
Silane, dimethyl(but-3-enyloxy)hexyloxy-
CID 91730309
Copper(1+);3-methanidylideneheptoxy(trimethyl)silane
CID 134980688
6-[Tert-butyl(dimethyl)silyl]oxy-3-methylidenehexan-1-ol
CID 58667950
Trimethyl-(3-methylidenecyclohexyl)oxysilane
CID 67848624
Ditert-butyl-methoxy-(4-methylidenehexoxy)silane
CID 123429827

Frequently Asked Questions

What is the IUPAC name of hexoxy-dimethyl-(3-methylbut-3-enoxy)silane?
The IUPAC name of hexoxy-dimethyl-(3-methylbut-3-enoxy)silane (CID 91730344) is hexoxy-dimethyl-(3-methylbut-3-enoxy)silane.
What is the SMILES notation for hexoxy-dimethyl-(3-methylbut-3-enoxy)silane?
The canonical SMILES for hexoxy-dimethyl-(3-methylbut-3-enoxy)silane is C=C(C)CCO[Si](C)(C)OCCCCCC.
What is the InChIKey of hexoxy-dimethyl-(3-methylbut-3-enoxy)silane?
The InChIKey is VNXRZQHUJPNVRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28O2Si/c1-6-7-8-9-11-14-16(4,5)15-12-10-13(2)3/h2,6-12H2,1,3-5H3.
What are the key properties of hexoxy-dimethyl-(3-methylbut-3-enoxy)silane?
hexoxy-dimethyl-(3-methylbut-3-enoxy)silane has a molecular weight of 244.45 g/mol, XLogP of 4.27, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hexoxy-dimethyl-(3-methylbut-3-enoxy)silane is sourced from PubChem (CID 91730344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).