2-(oxiran-2-ylmethoxymethyl)oxirane;oxophosphane

C6H11O4P — CID 22290133

IUPAC2-(oxiran-2-ylmethoxymethyl)oxirane;oxophosphane
SMILESC(OCC1CO1)C1CO1.O=P
InChIInChI=1S/C6H10O3.HOP/c1(5-3-8-5)7-2-6-4-9-6;1-2/h5-6H,1-4H2;2H
InChIKeyFRGVCAFUBFDDHD-UHFFFAOYSA-N
MW178.12 g/mol
LogP0.28
Rot. Bonds4

About 2-(oxiran-2-ylmethoxymethyl)oxirane;oxophosphane

2-(oxiran-2-ylmethoxymethyl)oxirane;oxophosphane (PubChem CID 22290133) has the molecular formula C6H11O4P and a molecular weight of 178.12 g/mol. Its IUPAC name is 2-(oxiran-2-ylmethoxymethyl)oxirane;oxophosphane.

Molecular Properties

Compound Name2-(oxiran-2-ylmethoxymethyl)oxirane;oxophosphane
PubChem CID22290133
Molecular FormulaC6H11O4P
Molecular Weight178.12 g/mol
Exact Mass178.04
IUPAC Name2-(oxiran-2-ylmethoxymethyl)oxirane;oxophosphane
SMILESC(OCC1CO1)C1CO1.O=P
InChIInChI=1S/C6H10O3.HOP/c1(5-3-8-5)7-2-6-4-9-6;1-2/h5-6H,1-4H2;2H
InChIKeyFRGVCAFUBFDDHD-UHFFFAOYSA-N
XLogP0.28
TPSA51.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.12
LogP ≤ 50.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

methane;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 167637417
2-(oxiran-2-ylmethoxymethyl)oxirane;sulfur trioxide
CID 87769776
2-(oxiran-2-ylmethoxymethyl)oxirane diazide
CID 175700488
ethanol;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 87071861
(2R)-2-[[4-(oxiran-2-ylmethoxymethyl)cyclohexyl]methoxymethyl]oxirane
CID 88922210
2-(oxiran-2-ylmethoxymethyl)oxirane;thiirene
CID 88761424
2-(oxiran-2-ylmethoxymethyl)oxirane;1,3,5-triazinane-2,4,6-trione
CID 174688773
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(oxiran-2-ylmethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]oxirane
CID 58765936
2-methylprop-1-ene;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 87296159
cyclopentane;ethane-1,2-diol;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 88518341
ethane-1,2-diol;ethene;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 173313374
hexanedial;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 166784173

Frequently Asked Questions

What is the IUPAC name of 2-(oxiran-2-ylmethoxymethyl)oxirane;oxophosphane?
The IUPAC name of 2-(oxiran-2-ylmethoxymethyl)oxirane;oxophosphane (CID 22290133) is 2-(oxiran-2-ylmethoxymethyl)oxirane;oxophosphane.
What is the SMILES notation for 2-(oxiran-2-ylmethoxymethyl)oxirane;oxophosphane?
The canonical SMILES for 2-(oxiran-2-ylmethoxymethyl)oxirane;oxophosphane is C(OCC1CO1)C1CO1.O=P.
What is the InChIKey of 2-(oxiran-2-ylmethoxymethyl)oxirane;oxophosphane?
The InChIKey is FRGVCAFUBFDDHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10O3.HOP/c1(5-3-8-5)7-2-6-4-9-6;1-2/h5-6H,1-4H2;2H.
What are the key properties of 2-(oxiran-2-ylmethoxymethyl)oxirane;oxophosphane?
2-(oxiran-2-ylmethoxymethyl)oxirane;oxophosphane has a molecular weight of 178.12 g/mol, XLogP of 0.28, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxiran-2-ylmethoxymethyl)oxirane;oxophosphane is sourced from PubChem (CID 22290133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).