2-cyclohexyloxy-5,5-dimethyl-1,3,2-dioxaphosphinane

C11H21O3P — CID 21448852

IUPAC2-cyclohexyloxy-5,5-dimethyl-1,3,2-dioxaphosphinane
SMILESCC1(C)COP(OC2CCCCC2)OC1
InChIInChI=1S/C11H21O3P/c1-11(2)8-12-15(13-9-11)14-10-6-4-3-5-7-10/h10H,3-9H2,1-2H3
InChIKeyCQYJDCFMMUXMFB-UHFFFAOYSA-N
MW232.26 g/mol
LogP3.64
Rot. Bonds2

About 2-cyclohexyloxy-5,5-dimethyl-1,3,2-dioxaphosphinane

2-cyclohexyloxy-5,5-dimethyl-1,3,2-dioxaphosphinane (PubChem CID 21448852) has the molecular formula C11H21O3P and a molecular weight of 232.26 g/mol. Its IUPAC name is 2-cyclohexyloxy-5,5-dimethyl-1,3,2-dioxaphosphinane.

Molecular Properties

Compound Name2-cyclohexyloxy-5,5-dimethyl-1,3,2-dioxaphosphinane
PubChem CID21448852
Molecular FormulaC11H21O3P
Molecular Weight232.26 g/mol
Exact Mass232.12
IUPAC Name2-cyclohexyloxy-5,5-dimethyl-1,3,2-dioxaphosphinane
SMILESCC1(C)COP(OC2CCCCC2)OC1
InChIInChI=1S/C11H21O3P/c1-11(2)8-12-15(13-9-11)14-10-6-4-3-5-7-10/h10H,3-9H2,1-2H3
InChIKeyCQYJDCFMMUXMFB-UHFFFAOYSA-N
XLogP3.64
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.26
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-cyclopentyloxy-5,5-dimethyl-1,3,2-dioxaphosphinane
CID 21448936
3,9-dicyclohexyloxy-2,4,8,10-tetraoxa-3,9-diphosphaspiro[5.5]undecane
CID 22899546
2-cyclohexyloxy-2-methyloxirane
CID 89006811
2-(2-methoxyethoxy)-5,5-dimethyl-1,3,2-dioxaphosphinane
CID 591931
9-[2,4-bis(2-cyclohexylpropan-2-yl)cycloheptyl]oxy-3-[2,4-bis(2-cyclohexylpropan-2-yl)cyclohexyl]oxy-2,4,8,10-tetraoxa-3,9-diphosphaspiro[5.5]undecane
CID 143459144
2,5,5,8,11,11-hexamethyl-1,3,7,9-tetraoxa-2,8-diphosphacyclododecane
CID 23420038
2-butoxy-5,5-dimethyl-1,3,2-dioxaphosphinane
CID 549749
2-[2,2-bis(chloromethyl)-3-[(5,5-dimethyl-1,3,2-dioxaphosphinan-2-yl)oxy]propoxy]-5,5-dimethyl-1,3,2-dioxaphosphinane
CID 143058585
2-cyclohexyloxy-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CID 11984021
1-cyclohexyloxy-1-methylcyclohexane
CID 57243949
methoxycyclooctane
CID 551195
cyclohexyloxy(dimethyl)silane
CID 575341

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyloxy-5,5-dimethyl-1,3,2-dioxaphosphinane?
The IUPAC name of 2-cyclohexyloxy-5,5-dimethyl-1,3,2-dioxaphosphinane (CID 21448852) is 2-cyclohexyloxy-5,5-dimethyl-1,3,2-dioxaphosphinane.
What is the SMILES notation for 2-cyclohexyloxy-5,5-dimethyl-1,3,2-dioxaphosphinane?
The canonical SMILES for 2-cyclohexyloxy-5,5-dimethyl-1,3,2-dioxaphosphinane is CC1(C)COP(OC2CCCCC2)OC1.
What is the InChIKey of 2-cyclohexyloxy-5,5-dimethyl-1,3,2-dioxaphosphinane?
The InChIKey is CQYJDCFMMUXMFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21O3P/c1-11(2)8-12-15(13-9-11)14-10-6-4-3-5-7-10/h10H,3-9H2,1-2H3.
What are the key properties of 2-cyclohexyloxy-5,5-dimethyl-1,3,2-dioxaphosphinane?
2-cyclohexyloxy-5,5-dimethyl-1,3,2-dioxaphosphinane has a molecular weight of 232.26 g/mol, XLogP of 3.64, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyloxy-5,5-dimethyl-1,3,2-dioxaphosphinane is sourced from PubChem (CID 21448852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).