2-(phosphorosooxymethyl)oxolane

C5H9O3P — CID 58971159

IUPAC2-(phosphorosooxymethyl)oxolane
SMILESO=POCC1CCCO1
InChIInChI=1S/C5H9O3P/c6-9-8-4-5-2-1-3-7-5/h5H,1-4H2
InChIKeyXINSZWWNDOYQMK-UHFFFAOYSA-N
MW148.10 g/mol
LogP1.39
Rot. Bonds3

About 2-(phosphorosooxymethyl)oxolane

2-(phosphorosooxymethyl)oxolane (PubChem CID 58971159) has the molecular formula C5H9O3P and a molecular weight of 148.10 g/mol. Its IUPAC name is 2-(phosphorosooxymethyl)oxolane.

Molecular Properties

Compound Name2-(phosphorosooxymethyl)oxolane
PubChem CID58971159
Molecular FormulaC5H9O3P
Molecular Weight148.10 g/mol
Exact Mass148.03
IUPAC Name2-(phosphorosooxymethyl)oxolane
SMILESO=POCC1CCCO1
InChIInChI=1S/C5H9O3P/c6-9-8-4-5-2-1-3-7-5/h5H,1-4H2
InChIKeyXINSZWWNDOYQMK-UHFFFAOYSA-N
XLogP1.39
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.10
LogP ≤ 51.39
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

oxolan-2-ylmethyl hypochlorite
CID 22491519
(2R)-2-(sulfanyloxymethyl)oxolane
CID 139553525
bis[[(2R)-oxolan-2-yl]methyl] [(2S)-oxolan-2-yl]methyl borate
CID 124629023
trimethyl(oxolan-2-ylmethoxy)silane
CID 551445
[(2S)-oxolan-2-yl]methoxymethanamine
CID 126553312
ethane;oxolan-2-ylmethoxythallium
CID 142985824
methyl-oxo-(oxolan-2-ylmethoxy)phosphanium
CID 59116285
2-oxo-2-(oxolan-2-ylmethoxy)acetic acid
CID 154107225
1-(oxolan-2-ylmethoxy)propan-2-one
CID 43798300
tris(oxolan-2-ylmethoxy)methylsilane
CID 123161768
[(2R)-oxolan-2-yl]methyl propanoate
CID 36691172
2-[[(2R)-oxolan-2-yl]methoxy]ethylazanium
CID 7219875

Frequently Asked Questions

What is the IUPAC name of 2-(phosphorosooxymethyl)oxolane?
The IUPAC name of 2-(phosphorosooxymethyl)oxolane (CID 58971159) is 2-(phosphorosooxymethyl)oxolane.
What is the SMILES notation for 2-(phosphorosooxymethyl)oxolane?
The canonical SMILES for 2-(phosphorosooxymethyl)oxolane is O=POCC1CCCO1.
What is the InChIKey of 2-(phosphorosooxymethyl)oxolane?
The InChIKey is XINSZWWNDOYQMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9O3P/c6-9-8-4-5-2-1-3-7-5/h5H,1-4H2.
What are the key properties of 2-(phosphorosooxymethyl)oxolane?
2-(phosphorosooxymethyl)oxolane has a molecular weight of 148.10 g/mol, XLogP of 1.39, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(phosphorosooxymethyl)oxolane is sourced from PubChem (CID 58971159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).