2-(cyclohexen-1-yloxy)-1,3,2-dioxaphospholane

C8H13O3P — CID 23272765

IUPAC2-(cyclohexen-1-yloxy)-1,3,2-dioxaphospholane
SMILESC1=C(OP2OCCO2)CCCC1
InChIInChI=1S/C8H13O3P/c1-2-4-8(5-3-1)11-12-9-6-7-10-12/h4H,1-3,5-7H2
InChIKeyXLRYDLBFYFZPTQ-UHFFFAOYSA-N
MW188.16 g/mol
LogP2.73
Rot. Bonds2

About 2-(cyclohexen-1-yloxy)-1,3,2-dioxaphospholane

2-(cyclohexen-1-yloxy)-1,3,2-dioxaphospholane (PubChem CID 23272765) has the molecular formula C8H13O3P and a molecular weight of 188.16 g/mol. Its IUPAC name is 2-(cyclohexen-1-yloxy)-1,3,2-dioxaphospholane.

Molecular Properties

Compound Name2-(cyclohexen-1-yloxy)-1,3,2-dioxaphospholane
PubChem CID23272765
Molecular FormulaC8H13O3P
Molecular Weight188.16 g/mol
Exact Mass188.06
IUPAC Name2-(cyclohexen-1-yloxy)-1,3,2-dioxaphospholane
SMILESC1=C(OP2OCCO2)CCCC1
InChIInChI=1S/C8H13O3P/c1-2-4-8(5-3-1)11-12-9-6-7-10-12/h4H,1-3,5-7H2
InChIKeyXLRYDLBFYFZPTQ-UHFFFAOYSA-N
XLogP2.73
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.16
LogP ≤ 52.73
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

cyclohexen-1-yl hypoiodite
CID 145005942
(1E)-1-methoxycyclotridecene
CID 5463530
(1E)-1-methoxycyclotetradecene
CID 164771746
2-[(1E)-cycloocten-1-yl]oxyethanol
CID 170306733
cyclohexen-1-yloxy(triphenyl)stannane
CID 16698206
tert-butyl-(cyclododecen-1-yloxy)-dimethylsilane
CID 71357243
(1E)-1-ethoxycyclodecene
CID 164771748
(1E)-1-ethoxycyclodecene;(1E)-1-ethoxycyclododecene;1-ethoxycycloheptene;1-ethoxycyclohexene;(1E)-1-ethoxycyclononene;(1E)-1-ethoxycyclooctene;(1E)-1-ethoxycyclotetradecene;(1E)-1-ethoxycyclotridecene;(1E)-1-ethoxycycloundecene
CID 165044943
1-ethylperoxycyclohexene
CID 140972894
1-(cyclodecen-1-yl)cyclodecene
CID 54296371
(1E)-1-[(1E)-cyclopentadecen-1-yl]cyclopentadecene
CID 139760940
2-(cyclohepten-1-yloxy)-N,N-dimethylethanamine
CID 23238003

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexen-1-yloxy)-1,3,2-dioxaphospholane?
The IUPAC name of 2-(cyclohexen-1-yloxy)-1,3,2-dioxaphospholane (CID 23272765) is 2-(cyclohexen-1-yloxy)-1,3,2-dioxaphospholane.
What is the SMILES notation for 2-(cyclohexen-1-yloxy)-1,3,2-dioxaphospholane?
The canonical SMILES for 2-(cyclohexen-1-yloxy)-1,3,2-dioxaphospholane is C1=C(OP2OCCO2)CCCC1.
What is the InChIKey of 2-(cyclohexen-1-yloxy)-1,3,2-dioxaphospholane?
The InChIKey is XLRYDLBFYFZPTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13O3P/c1-2-4-8(5-3-1)11-12-9-6-7-10-12/h4H,1-3,5-7H2.
What are the key properties of 2-(cyclohexen-1-yloxy)-1,3,2-dioxaphospholane?
2-(cyclohexen-1-yloxy)-1,3,2-dioxaphospholane has a molecular weight of 188.16 g/mol, XLogP of 2.73, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexen-1-yloxy)-1,3,2-dioxaphospholane is sourced from PubChem (CID 23272765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).