2,6-dihydroxy-1,3,5,7-tetraoxa-2λ5,6λ5-diphosphaspiro[3.3]heptane 2,6-dioxide

CH2O8P2 — CID 141425610

IUPAC2,6-dihydroxy-1,3,5,7-tetraoxa-2λ5,6λ5-diphosphaspiro[3.3]heptane 2,6-dioxide
SMILESO=P1(O)OC2(O1)OP(=O)(O)O2
InChIInChI=1S/CH2O8P2/c2-10(3)6-1(7-10)8-11(4,5)9-1/h(H,2,3)(H,4,5)
InChIKeyHMZYBCRBGVTJCM-UHFFFAOYSA-N
MW203.97 g/mol
LogP-0.11
Rot. Bonds

About 2,6-dihydroxy-1,3,5,7-tetraoxa-2λ5,6λ5-diphosphaspiro[3.3]heptane 2,6-dioxide

2,6-dihydroxy-1,3,5,7-tetraoxa-2λ5,6λ5-diphosphaspiro[3.3]heptane 2,6-dioxide (PubChem CID 141425610) has the molecular formula CH2O8P2 and a molecular weight of 203.97 g/mol. Its IUPAC name is 2,6-dihydroxy-1,3,5,7-tetraoxa-2λ5,6λ5-diphosphaspiro[3.3]heptane 2,6-dioxide.

Molecular Properties

Compound Name2,6-dihydroxy-1,3,5,7-tetraoxa-2λ5,6λ5-diphosphaspiro[3.3]heptane 2,6-dioxide
PubChem CID141425610
Molecular FormulaCH2O8P2
Molecular Weight203.97 g/mol
Exact Mass203.92
IUPAC Name2,6-dihydroxy-1,3,5,7-tetraoxa-2λ5,6λ5-diphosphaspiro[3.3]heptane 2,6-dioxide
SMILESO=P1(O)OC2(O1)OP(=O)(O)O2
InChIInChI=1S/CH2O8P2/c2-10(3)6-1(7-10)8-11(4,5)9-1/h(H,2,3)(H,4,5)
InChIKeyHMZYBCRBGVTJCM-UHFFFAOYSA-N
XLogP-0.11
TPSA111.52 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.97
LogP ≤ 5-0.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2,6-dihydroxy-1,3,5,7-tetraoxa-2λ5,6λ5-diphosphaspiro[3.3]heptane 2,6-dioxide;2,6-dihydroxy-1,3,5,7-tetraoxa-2λ5,6λ5-diphospha-4-stannaspiro[3.3]heptane 2,6-dioxide
CID 170699534
methanol;2,4,6-trihydroxy-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide
CID 174239066
CID 173204906
CID 173204906
2,6,10-trihydroxy-1,3,5,7,9,11-hexaoxa-2λ5,6λ5,10λ5-triphosphacyclododecane 2,6,10-trioxide
CID 172770499
disodium;hydride;5-hydroxy-1,2,3,4,5λ5-tetraoxaphospholane 5-oxide
CID 173145201
4,4,5,5,6,7-hexafluoro-2-hydroxy-7-propan-2-yl-1,3,2λ5-dioxaphosphepane 2-oxide
CID 87919069
4,5-difluoro-2-hydroxy-4-propyl-5-(trifluoromethyl)-1,3,2λ5-dioxaphospholane 2-oxide
CID 87919190
4,6,8,10,12-pentahydroxy-2,4,6,8,10,12-hexaoxo-1,3,5,7,9,11-hexaoxa-2λ5,4λ5,6λ5,8λ5,10λ5,12λ5-hexaphosphacyclododecan-2-amine
CID 23036017
2,4-dihydroxy-1,3,5,2λ5,4λ5-trioxadiphosphinane 2,4-dioxide
CID 18459455
CID 173087948
CID 173087948
2-hydroxy-1,3,5,2λ5-dioxazaphosphinane 2-oxide
CID 18697532
2-hydroxy-1,3-dioxa-2λ5-phosphacyclododecane 2-oxide
CID 154259848

Frequently Asked Questions

What is the IUPAC name of 2,6-dihydroxy-1,3,5,7-tetraoxa-2λ5,6λ5-diphosphaspiro[3.3]heptane 2,6-dioxide?
The IUPAC name of 2,6-dihydroxy-1,3,5,7-tetraoxa-2λ5,6λ5-diphosphaspiro[3.3]heptane 2,6-dioxide (CID 141425610) is 2,6-dihydroxy-1,3,5,7-tetraoxa-2λ5,6λ5-diphosphaspiro[3.3]heptane 2,6-dioxide.
What is the SMILES notation for 2,6-dihydroxy-1,3,5,7-tetraoxa-2λ5,6λ5-diphosphaspiro[3.3]heptane 2,6-dioxide?
The canonical SMILES for 2,6-dihydroxy-1,3,5,7-tetraoxa-2λ5,6λ5-diphosphaspiro[3.3]heptane 2,6-dioxide is O=P1(O)OC2(O1)OP(=O)(O)O2.
What is the InChIKey of 2,6-dihydroxy-1,3,5,7-tetraoxa-2λ5,6λ5-diphosphaspiro[3.3]heptane 2,6-dioxide?
The InChIKey is HMZYBCRBGVTJCM-UHFFFAOYSA-N. The full InChI is InChI=1S/CH2O8P2/c2-10(3)6-1(7-10)8-11(4,5)9-1/h(H,2,3)(H,4,5).
What are the key properties of 2,6-dihydroxy-1,3,5,7-tetraoxa-2λ5,6λ5-diphosphaspiro[3.3]heptane 2,6-dioxide?
2,6-dihydroxy-1,3,5,7-tetraoxa-2λ5,6λ5-diphosphaspiro[3.3]heptane 2,6-dioxide has a molecular weight of 203.97 g/mol, XLogP of -0.11, 0 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dihydroxy-1,3,5,7-tetraoxa-2λ5,6λ5-diphosphaspiro[3.3]heptane 2,6-dioxide is sourced from PubChem (CID 141425610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).