carbon dioxide;(4-chloro-4-methylcyclohexen-1-yl)oxy-trimethylsilane

C11H19ClO3Si — CID 162029724

IUPACcarbon dioxide;(4-chloro-4-methylcyclohexen-1-yl)oxy-trimethylsilane
SMILESCC1(Cl)CC=C(O[Si](C)(C)C)CC1.O=C=O
InChIInChI=1S/C10H19ClOSi.CO2/c1-10(11)7-5-9(6-8-10)12-13(2,3)4;2-1-3/h5H,6-8H2,1-4H3;
InChIKeyYVVYTTOTGWTHOF-UHFFFAOYSA-N
MW262.81 g/mol
LogP3.32
Rot. Bonds2

About carbon dioxide;(4-chloro-4-methylcyclohexen-1-yl)oxy-trimethylsilane

carbon dioxide;(4-chloro-4-methylcyclohexen-1-yl)oxy-trimethylsilane (PubChem CID 162029724) has the molecular formula C11H19ClO3Si and a molecular weight of 262.81 g/mol. Its IUPAC name is carbon dioxide;(4-chloro-4-methylcyclohexen-1-yl)oxy-trimethylsilane.

Molecular Properties

Compound Namecarbon dioxide;(4-chloro-4-methylcyclohexen-1-yl)oxy-trimethylsilane
PubChem CID162029724
Molecular FormulaC11H19ClO3Si
Molecular Weight262.81 g/mol
Exact Mass262.08
IUPAC Namecarbon dioxide;(4-chloro-4-methylcyclohexen-1-yl)oxy-trimethylsilane
SMILESCC1(Cl)CC=C(O[Si](C)(C)C)CC1.O=C=O
InChIInChI=1S/C10H19ClOSi.CO2/c1-10(11)7-5-9(6-8-10)12-13(2,3)4;2-1-3/h5H,6-8H2,1-4H3;
InChIKeyYVVYTTOTGWTHOF-UHFFFAOYSA-N
XLogP3.32
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.81
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

dimethyl (3R)-6-trimethylsilyloxyspiro[2.5]oct-6-ene-2,2-dicarboxylate
CID 25208498
(4,4-dimethylcyclohexen-1-yl)oxy-triethylsilane
CID 101201262
4-trimethylsilyloxycyclohex-4-ene-1,1,2,2-tetracarbonitrile
CID 134992421
2-methoxy-1-methyl-4-trimethylsilyloxycyclohex-3-ene-1-carbonitrile
CID 11207183
tert-butyl-dimethyl-(2-oxaspiro[3.5]non-6-en-7-yloxy)silane
CID 174035895
1-methoxy-4,4-dimethylcyclohexene
CID 558759
O-(4,4-dimethylcyclohexen-1-yl)hydroxylamine
CID 67709346
(3-ethenyl-3-methylcyclohexen-1-yl)oxy-trimethylsilane
CID 606815
1-bromo-4-tri(propan-2-yl)silyloxycyclohex-3-ene-1-carbaldehyde
CID 134980506
10,13-dimethyl-3-trimethylsilyloxy-1,2,5,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one
CID 588408
trimethyl-(3-methyl-3-tributylstannylcyclohexen-1-yl)oxysilane
CID 86132156
trimethyl-[(6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl)oxy]silane
CID 12771787

Frequently Asked Questions

What is the IUPAC name of carbon dioxide;(4-chloro-4-methylcyclohexen-1-yl)oxy-trimethylsilane?
The IUPAC name of carbon dioxide;(4-chloro-4-methylcyclohexen-1-yl)oxy-trimethylsilane (CID 162029724) is carbon dioxide;(4-chloro-4-methylcyclohexen-1-yl)oxy-trimethylsilane.
What is the SMILES notation for carbon dioxide;(4-chloro-4-methylcyclohexen-1-yl)oxy-trimethylsilane?
The canonical SMILES for carbon dioxide;(4-chloro-4-methylcyclohexen-1-yl)oxy-trimethylsilane is CC1(Cl)CC=C(O[Si](C)(C)C)CC1.O=C=O.
What is the InChIKey of carbon dioxide;(4-chloro-4-methylcyclohexen-1-yl)oxy-trimethylsilane?
The InChIKey is YVVYTTOTGWTHOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19ClOSi.CO2/c1-10(11)7-5-9(6-8-10)12-13(2,3)4;2-1-3/h5H,6-8H2,1-4H3;.
What are the key properties of carbon dioxide;(4-chloro-4-methylcyclohexen-1-yl)oxy-trimethylsilane?
carbon dioxide;(4-chloro-4-methylcyclohexen-1-yl)oxy-trimethylsilane has a molecular weight of 262.81 g/mol, XLogP of 3.32, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for carbon dioxide;(4-chloro-4-methylcyclohexen-1-yl)oxy-trimethylsilane is sourced from PubChem (CID 162029724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).