[(2R)-oxirane-2-carbonyl]phosphonic acid

C3H5O5P — CID 10511027

IUPAC[(2R)-oxirane-2-carbonyl]phosphonic acid
SMILESO=C([C@H]1CO1)P(=O)(O)O
InChIInChI=1S/C3H5O5P/c4-3(2-1-8-2)9(5,6)7/h2H,1H2,(H2,5,6,7)/t2-/m1/s1
InChIKeyLGZHNIKVEUTWHC-UWTATZPHSA-N
MW152.04 g/mol
LogP-0.91
Rot. Bonds2

About [(2R)-oxirane-2-carbonyl]phosphonic acid

[(2R)-oxirane-2-carbonyl]phosphonic acid (PubChem CID 10511027) has the molecular formula C3H5O5P and a molecular weight of 152.04 g/mol. Its IUPAC name is [(2R)-oxirane-2-carbonyl]phosphonic acid.

Molecular Properties

Compound Name[(2R)-oxirane-2-carbonyl]phosphonic acid
PubChem CID10511027
Molecular FormulaC3H5O5P
Molecular Weight152.04 g/mol
Exact Mass151.99
IUPAC Name[(2R)-oxirane-2-carbonyl]phosphonic acid
SMILESO=C([C@H]1CO1)P(=O)(O)O
InChIInChI=1S/C3H5O5P/c4-3(2-1-8-2)9(5,6)7/h2H,1H2,(H2,5,6,7)/t2-/m1/s1
InChIKeyLGZHNIKVEUTWHC-UWTATZPHSA-N
XLogP-0.91
TPSA87.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.04
LogP ≤ 5-0.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

(2R)-oxirane-2-carbonyl chloride
CID 89298336
oxiran-2-yl(silyl)methanone
CID 123892930
CID 158871362
CID 158871362
potassium (2R)-oxirane-2-carboxylate
CID 23708734
aluminum tris(oxirane-2-carboxylate)
CID 175868162
dipotassium;oxirane-2-carboxylic acid;dihydroxide
CID 174960947
carbonic acid;oxirane-2-carboxamide
CID 87800333
1,6-bis(oxiran-2-yl)hexane-1,6-dione
CID 88967931
oxiran-2-ylmethanol;phosphoric acid
CID 87891587
1-[(2R)-oxiran-2-yl]hexan-1-one
CID 177406041
[(2R)-oxiran-2-yl]methyl (2R)-oxirane-2-carboxylate
CID 129390270
[(2S)-oxiran-2-yl]methyl (2S)-oxirane-2-carboxylate
CID 129390267

Frequently Asked Questions

What is the IUPAC name of [(2R)-oxirane-2-carbonyl]phosphonic acid?
The IUPAC name of [(2R)-oxirane-2-carbonyl]phosphonic acid (CID 10511027) is [(2R)-oxirane-2-carbonyl]phosphonic acid.
What is the SMILES notation for [(2R)-oxirane-2-carbonyl]phosphonic acid?
The canonical SMILES for [(2R)-oxirane-2-carbonyl]phosphonic acid is O=C([C@H]1CO1)P(=O)(O)O.
What is the InChIKey of [(2R)-oxirane-2-carbonyl]phosphonic acid?
The InChIKey is LGZHNIKVEUTWHC-UWTATZPHSA-N. The full InChI is InChI=1S/C3H5O5P/c4-3(2-1-8-2)9(5,6)7/h2H,1H2,(H2,5,6,7)/t2-/m1/s1.
What are the key properties of [(2R)-oxirane-2-carbonyl]phosphonic acid?
[(2R)-oxirane-2-carbonyl]phosphonic acid has a molecular weight of 152.04 g/mol, XLogP of -0.91, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-oxirane-2-carbonyl]phosphonic acid is sourced from PubChem (CID 10511027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).