carbonoperoxoyloxy hydroxy carbonate

C2H2O8 — CID 19088294

IUPACcarbonoperoxoyloxy hydroxy carbonate
SMILESO=C(OO)OOC(=O)OO
InChIInChI=1S/C2H2O8/c3-1(7-5)9-10-2(4)8-6/h5-6H
InChIKeyPBCSWFLAGCZQAK-UHFFFAOYSA-N
MW154.03 g/mol
LogP0.15
Rot. Bonds

About carbonoperoxoyloxy hydroxy carbonate

carbonoperoxoyloxy hydroxy carbonate (PubChem CID 19088294) has the molecular formula C2H2O8 and a molecular weight of 154.03 g/mol. Its IUPAC name is carbonoperoxoyloxy hydroxy carbonate.

Molecular Properties

Compound Namecarbonoperoxoyloxy hydroxy carbonate
PubChem CID19088294
Molecular FormulaC2H2O8
Molecular Weight154.03 g/mol
Exact Mass153.97
IUPAC Namecarbonoperoxoyloxy hydroxy carbonate
SMILESO=C(OO)OOC(=O)OO
InChIInChI=1S/C2H2O8/c3-1(7-5)9-10-2(4)8-6/h5-6H
InChIKeyPBCSWFLAGCZQAK-UHFFFAOYSA-N
XLogP0.15
TPSA111.52 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.03
LogP ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

Analyze carbonoperoxoyloxy hydroxy carbonate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

carbonoperoxoyloxy propan-2-yl carbonate
CID 146240336
azane;carbonoperoxoyloxy oxomethoxy carbonate;lanthanum;methane;nonahydrate
CID 161204835
azane;carbonoperoxoyloxy oxomethoxy carbonate;ethane;lanthanum;methane;nonahydrate
CID 158169855
carbonoperoxoyloxy oxomethoxy carbonate;ethane;methane;bis(yttrium);trihydrate
CID 157374425
hydroxy methyl carbonate
CID 158464551
hydroxy nitroso carbonate
CID 54562882
cyano hydroxy carbonate
CID 87497804
tert-butyl hydroxy carbonate
CID 19428429
hydroxy carbonobromidate
CID 88553867
carbonoperoxoic acid;iron
CID 87244357
carbonoperoxoic acid;silane
CID 175161162
carbonic acid;carbonoperoxoic acid
CID 87881933

Frequently Asked Questions

What is the IUPAC name of carbonoperoxoyloxy hydroxy carbonate?
The IUPAC name of carbonoperoxoyloxy hydroxy carbonate (CID 19088294) is carbonoperoxoyloxy hydroxy carbonate.
What is the SMILES notation for carbonoperoxoyloxy hydroxy carbonate?
The canonical SMILES for carbonoperoxoyloxy hydroxy carbonate is O=C(OO)OOC(=O)OO.
What is the InChIKey of carbonoperoxoyloxy hydroxy carbonate?
The InChIKey is PBCSWFLAGCZQAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H2O8/c3-1(7-5)9-10-2(4)8-6/h5-6H.
What are the key properties of carbonoperoxoyloxy hydroxy carbonate?
carbonoperoxoyloxy hydroxy carbonate has a molecular weight of 154.03 g/mol, XLogP of 0.15, 0 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for carbonoperoxoyloxy hydroxy carbonate is sourced from PubChem (CID 19088294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).