phosphorosooxycyclobutane

C4H7O2P — CID 159476580

IUPACphosphorosooxycyclobutane
SMILESO=POC1CCC1
InChIInChI=1S/C4H7O2P/c5-7-6-4-2-1-3-4/h4H,1-3H2
InChIKeyHZWXOAOCEGDSTN-UHFFFAOYSA-N
MW118.07 g/mol
LogP1.76
Rot. Bonds2

About phosphorosooxycyclobutane

phosphorosooxycyclobutane (PubChem CID 159476580) has the molecular formula C4H7O2P and a molecular weight of 118.07 g/mol. Its IUPAC name is phosphorosooxycyclobutane.

Molecular Properties

Compound Namephosphorosooxycyclobutane
PubChem CID159476580
Molecular FormulaC4H7O2P
Molecular Weight118.07 g/mol
Exact Mass118.02
IUPAC Namephosphorosooxycyclobutane
SMILESO=POC1CCC1
InChIInChI=1S/C4H7O2P/c5-7-6-4-2-1-3-4/h4H,1-3H2
InChIKeyHZWXOAOCEGDSTN-UHFFFAOYSA-N
XLogP1.76
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.07
LogP ≤ 51.76
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

phosphorosooxycyclohexane
CID 18717017
molecular hydrogen;phosphorosooxycyclohexane
CID 159066743
cyclobutyloxycyclobutane;hydrofluoride
CID 174842144
di(cyclooctyloxy)-oxophosphanium
CID 164745910
dicyclobutyl sulfate
CID 87280468
tricyclobutyl phosphate
CID 66609052
cyclobutyloxycyclohexane
CID 89332762
10,13-diethoxy-3-phosphorosooxy-oxacyclohexadecan-2-one
CID 139610366
dicyclobutyl methanedisulfonate
CID 89440421
cyclooctyloxy(tricyclopentyl)silane
CID 142301939
cyclobutyl carbonofluoridate
CID 126746202
cyclobutyl 4-bromobutanoate
CID 591081

Frequently Asked Questions

What is the IUPAC name of phosphorosooxycyclobutane?
The IUPAC name of phosphorosooxycyclobutane (CID 159476580) is phosphorosooxycyclobutane.
What is the SMILES notation for phosphorosooxycyclobutane?
The canonical SMILES for phosphorosooxycyclobutane is O=POC1CCC1.
What is the InChIKey of phosphorosooxycyclobutane?
The InChIKey is HZWXOAOCEGDSTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7O2P/c5-7-6-4-2-1-3-4/h4H,1-3H2.
What are the key properties of phosphorosooxycyclobutane?
phosphorosooxycyclobutane has a molecular weight of 118.07 g/mol, XLogP of 1.76, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phosphorosooxycyclobutane is sourced from PubChem (CID 159476580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).