CID 102256300

C2H3O3 — CID 102256300

IUPAC—
SMILESO=[C]OCO
InChIInChI=1S/C2H3O3/c3-1-5-2-4/h3H,1H2
InChIKeySMBLNOZBYYGDRZ-UHFFFAOYSA-N
MW75.04 g/mol
LogP-0.98
Rot. Bonds2

About CID 102256300

CID 102256300 (PubChem CID 102256300) has the molecular formula C2H3O3 and a molecular weight of 75.04 g/mol.

Molecular Properties

Compound NameCID 102256300
PubChem CID102256300
Molecular FormulaC2H3O3
Molecular Weight75.04 g/mol
Exact Mass75.01
IUPAC Name—
SMILESO=[C]OCO
InChIInChI=1S/C2H3O3/c3-1-5-2-4/h3H,1H2
InChIKeySMBLNOZBYYGDRZ-UHFFFAOYSA-N
XLogP-0.98
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50075.04
LogP ≤ 5-0.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 102256300?
The IUPAC name of CID 102256300 (CID 102256300) is not available.
What is the SMILES notation for CID 102256300?
The canonical SMILES for CID 102256300 is O=[C]OCO.
What is the InChIKey of CID 102256300?
The InChIKey is SMBLNOZBYYGDRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H3O3/c3-1-5-2-4/h3H,1H2.
What are the key properties of CID 102256300?
CID 102256300 has a molecular weight of 75.04 g/mol, XLogP of -0.98, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 102256300 is sourced from PubChem (CID 102256300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).