2,5-dihydroxy-2,5-dioxo-1,2λ5,5λ5-oxadiphospholan-3-ol

C2H6O6P2 — CID 152624671

IUPAC2,5-dihydroxy-2,5-dioxo-1,2λ5,5λ5-oxadiphospholan-3-ol
SMILESO=P1(O)CC(O)P(=O)(O)O1
InChIInChI=1S/C2H6O6P2/c3-2-1-9(4,5)8-10(2,6)7/h2-3H,1H2,(H,4,5)(H,6,7)
InChIKeyZCGHXVGMEHAYPI-UHFFFAOYSA-N
MW188.01 g/mol
LogP-0.29
Rot. Bonds

About 2,5-dihydroxy-2,5-dioxo-1,2λ5,5λ5-oxadiphospholan-3-ol

2,5-dihydroxy-2,5-dioxo-1,2λ5,5λ5-oxadiphospholan-3-ol (PubChem CID 152624671) has the molecular formula C2H6O6P2 and a molecular weight of 188.01 g/mol. Its IUPAC name is 2,5-dihydroxy-2,5-dioxo-1,2λ5,5λ5-oxadiphospholan-3-ol.

Molecular Properties

Compound Name2,5-dihydroxy-2,5-dioxo-1,2λ5,5λ5-oxadiphospholan-3-ol
PubChem CID152624671
Molecular FormulaC2H6O6P2
Molecular Weight188.01 g/mol
Exact Mass187.96
IUPAC Name2,5-dihydroxy-2,5-dioxo-1,2λ5,5λ5-oxadiphospholan-3-ol
SMILESO=P1(O)CC(O)P(=O)(O)O1
InChIInChI=1S/C2H6O6P2/c3-2-1-9(4,5)8-10(2,6)7/h2-3H,1H2,(H,4,5)(H,6,7)
InChIKeyZCGHXVGMEHAYPI-UHFFFAOYSA-N
XLogP-0.29
TPSA104.06 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.01
LogP ≤ 5-0.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-cycloheptyl-2,4-dihydroxy-2,4-dioxo-1,2λ5,4λ5-oxadiphosphetan-3-amine
CID 101196354
2,4-dihydroxy-2-oxo-1,2λ5-oxaphospholane-3-carboxylic acid
CID 151519448
2,4-dihydroxy-3-pyrrolidin-1-yl-1,2λ5,4λ5-oxadiphosphetane 2,4-dioxide
CID 101154328
(3S,4S,5R)-2-hydroxy-2-oxo-1,2lambda5-oxaphosphinane-3,4,5-triol
CID 10535473
(6S,7R)-2,4-dihydroxy-6-(hydroxymethyl)-2,4-dioxo-1,3,5,2λ5,4λ5-trioxadiphosphocan-7-ol
CID 44582844
2,4-dihydroxy-1,3,5,2λ5,4λ5-trioxadiphosphinane 2,4-dioxide
CID 18459455
[(5S)-3-fluoro-2-hydroxy-2-oxo-1,2λ5-oxaphospholan-5-yl]methanol
CID 58881743
2-hydroxy-4-propan-2-yl-1,3,2λ5-dioxaphosphinane 2-oxide
CID 20528587
methanol;2,4,6-trihydroxy-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide
CID 174239066
2-oxa-1λ5,3λ5-diphosphabicyclo[1.1.0]butane 1,3-dioxide
CID 140978220
2-hydroxy-1,3-dioxa-2λ5-phosphacyclododecane 2-oxide
CID 154259848
4-ethynyl-2-hydroxy-1,2λ5-oxaphosphinane 2-oxide
CID 89445921

Frequently Asked Questions

What is the IUPAC name of 2,5-dihydroxy-2,5-dioxo-1,2λ5,5λ5-oxadiphospholan-3-ol?
The IUPAC name of 2,5-dihydroxy-2,5-dioxo-1,2λ5,5λ5-oxadiphospholan-3-ol (CID 152624671) is 2,5-dihydroxy-2,5-dioxo-1,2λ5,5λ5-oxadiphospholan-3-ol.
What is the SMILES notation for 2,5-dihydroxy-2,5-dioxo-1,2λ5,5λ5-oxadiphospholan-3-ol?
The canonical SMILES for 2,5-dihydroxy-2,5-dioxo-1,2λ5,5λ5-oxadiphospholan-3-ol is O=P1(O)CC(O)P(=O)(O)O1.
What is the InChIKey of 2,5-dihydroxy-2,5-dioxo-1,2λ5,5λ5-oxadiphospholan-3-ol?
The InChIKey is ZCGHXVGMEHAYPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6O6P2/c3-2-1-9(4,5)8-10(2,6)7/h2-3H,1H2,(H,4,5)(H,6,7).
What are the key properties of 2,5-dihydroxy-2,5-dioxo-1,2λ5,5λ5-oxadiphospholan-3-ol?
2,5-dihydroxy-2,5-dioxo-1,2λ5,5λ5-oxadiphospholan-3-ol has a molecular weight of 188.01 g/mol, XLogP of -0.29, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dihydroxy-2,5-dioxo-1,2λ5,5λ5-oxadiphospholan-3-ol is sourced from PubChem (CID 152624671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).