chloro-ethenyl-heptan-2-yloxy-methylsilane

C10H21ClOSi — CID 91720331

IUPACchloro-ethenyl-heptan-2-yloxy-methylsilane
SMILESC=C[Si](C)(Cl)OC(C)CCCCC
InChIInChI=1S/C10H21ClOSi/c1-5-7-8-9-10(3)12-13(4,11)6-2/h6,10H,2,5,7-9H2,1,3-4H3
InChIKeyRRYFCCGCHQJTTG-UHFFFAOYSA-N
MW220.82 g/mol
LogP4.01
Rot. Bonds7

About chloro-ethenyl-heptan-2-yloxy-methylsilane

chloro-ethenyl-heptan-2-yloxy-methylsilane (PubChem CID 91720331) has the molecular formula C10H21ClOSi and a molecular weight of 220.82 g/mol. Its IUPAC name is chloro-ethenyl-heptan-2-yloxy-methylsilane.

Molecular Properties

Compound Namechloro-ethenyl-heptan-2-yloxy-methylsilane
PubChem CID91720331
Molecular FormulaC10H21ClOSi
Molecular Weight220.82 g/mol
Exact Mass220.11
IUPAC Namechloro-ethenyl-heptan-2-yloxy-methylsilane
SMILESC=C[Si](C)(Cl)OC(C)CCCCC
InChIInChI=1S/C10H21ClOSi/c1-5-7-8-9-10(3)12-13(4,11)6-2/h6,10H,2,5,7-9H2,1,3-4H3
InChIKeyRRYFCCGCHQJTTG-UHFFFAOYSA-N
XLogP4.01
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.82
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Silane, methylvinyl(oct-4-yloxy)isopropoxy-
CID 91699097
Silane, methylvinyl(oct-2-yloxy)ethoxy-
CID 91723234
Silane, chlorodiethyl(2-hexyloxy)-
CID 91724160
Silane, methylvinyl(oct-2-yloxy)propoxy-
CID 91726228
Silane, chlorodiethyl(3-heptyloxy)-
CID 91727312
Silane, methylvinyl(hept-4-yloxy)ethoxy-
CID 91730049
Silane, methylvinyl(oct-4-yloxy)ethoxy-
CID 91730050
Silane, chlorodiethyl(4-octyloxy)-
CID 91731796
Silane, methylvinyl(hept-4-yloxy)propoxy-
CID 91733088
Silane, methylvinyl(oct-4-yloxy)propoxy-
CID 91733090
Silane, methylvinyl(hexyloxy)isopropoxy-
CID 91734929
Silane, methylvinyl(hept-4-yloxy)butoxy-
CID 91734978

Frequently Asked Questions

What is the IUPAC name of chloro-ethenyl-heptan-2-yloxy-methylsilane?
The IUPAC name of chloro-ethenyl-heptan-2-yloxy-methylsilane (CID 91720331) is chloro-ethenyl-heptan-2-yloxy-methylsilane.
What is the SMILES notation for chloro-ethenyl-heptan-2-yloxy-methylsilane?
The canonical SMILES for chloro-ethenyl-heptan-2-yloxy-methylsilane is C=C[Si](C)(Cl)OC(C)CCCCC.
What is the InChIKey of chloro-ethenyl-heptan-2-yloxy-methylsilane?
The InChIKey is RRYFCCGCHQJTTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21ClOSi/c1-5-7-8-9-10(3)12-13(4,11)6-2/h6,10H,2,5,7-9H2,1,3-4H3.
What are the key properties of chloro-ethenyl-heptan-2-yloxy-methylsilane?
chloro-ethenyl-heptan-2-yloxy-methylsilane has a molecular weight of 220.82 g/mol, XLogP of 4.01, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-ethenyl-heptan-2-yloxy-methylsilane is sourced from PubChem (CID 91720331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).