phosphorosooxycyclohexane

C6H11O2P — CID 18717017

IUPACphosphorosooxycyclohexane
SMILESO=POC1CCCCC1
InChIInChI=1S/C6H11O2P/c7-9-8-6-4-2-1-3-5-6/h6H,1-5H2
InChIKeyOMORXSCROSLLDY-UHFFFAOYSA-N
MW146.13 g/mol
LogP2.54
Rot. Bonds2

About phosphorosooxycyclohexane

phosphorosooxycyclohexane (PubChem CID 18717017) has the molecular formula C6H11O2P and a molecular weight of 146.13 g/mol. Its IUPAC name is phosphorosooxycyclohexane.

Molecular Properties

Compound Namephosphorosooxycyclohexane
PubChem CID18717017
Molecular FormulaC6H11O2P
Molecular Weight146.13 g/mol
Exact Mass146.05
IUPAC Namephosphorosooxycyclohexane
SMILESO=POC1CCCCC1
InChIInChI=1S/C6H11O2P/c7-9-8-6-4-2-1-3-5-6/h6H,1-5H2
InChIKeyOMORXSCROSLLDY-UHFFFAOYSA-N
XLogP2.54
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.13
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

molecular hydrogen;phosphorosooxycyclohexane
CID 159066743
phosphorosooxycyclobutane
CID 159476580
di(cyclooctyloxy)-oxophosphanium
CID 164745910
cyclooctyloxy(tricyclopentyl)silane
CID 142301939
1,4-bis[(4-cyclohexyloxycyclohexyl)oxy]cyclohexane
CID 140552812
cyclobutyloxycyclohexane
CID 89332762
10,13-diethoxy-3-phosphorosooxy-oxacyclohexadecan-2-one
CID 139610366
2-O-cycloheptyl 1-O-cyclooctyl oxalate
CID 57251206
dicyclononyl carbonate
CID 139618210
dicyclohexyloxy(oxo)azanium
CID 57042378
dicyclohexyl sulfite
CID 557841
formaldehyde;methoxycyclohexane
CID 142252216

Frequently Asked Questions

What is the IUPAC name of phosphorosooxycyclohexane?
The IUPAC name of phosphorosooxycyclohexane (CID 18717017) is phosphorosooxycyclohexane.
What is the SMILES notation for phosphorosooxycyclohexane?
The canonical SMILES for phosphorosooxycyclohexane is O=POC1CCCCC1.
What is the InChIKey of phosphorosooxycyclohexane?
The InChIKey is OMORXSCROSLLDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11O2P/c7-9-8-6-4-2-1-3-5-6/h6H,1-5H2.
What are the key properties of phosphorosooxycyclohexane?
phosphorosooxycyclohexane has a molecular weight of 146.13 g/mol, XLogP of 2.54, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phosphorosooxycyclohexane is sourced from PubChem (CID 18717017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).