CID 101224795

C13H7O2 — CID 101224795

IUPAC—
SMILES[O]c1ccc2cccc3c2c1C=CC3=O
InChIInChI=1S/C13H7O2/c14-11-6-4-8-2-1-3-9-12(15)7-5-10(11)13(8)9/h1-7H
InChIKeyXAEWCNDZNBEUFO-UHFFFAOYSA-N
MW195.20 g/mol
LogP3.19
Rot. Bonds

About CID 101224795

CID 101224795 (PubChem CID 101224795) has the molecular formula C13H7O2 and a molecular weight of 195.20 g/mol.

Molecular Properties

Compound NameCID 101224795
PubChem CID101224795
Molecular FormulaC13H7O2
Molecular Weight195.20 g/mol
Exact Mass195.04
IUPAC Name—
SMILES[O]c1ccc2cccc3c2c1C=CC3=O
InChIInChI=1S/C13H7O2/c14-11-6-4-8-2-1-3-9-12(15)7-5-10(11)13(8)9/h1-7H
InChIKeyXAEWCNDZNBEUFO-UHFFFAOYSA-N
XLogP3.19
TPSA36.97 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.20
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 101224795?
The IUPAC name of CID 101224795 (CID 101224795) is not available.
What is the SMILES notation for CID 101224795?
The canonical SMILES for CID 101224795 is [O]c1ccc2cccc3c2c1C=CC3=O.
What is the InChIKey of CID 101224795?
The InChIKey is XAEWCNDZNBEUFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7O2/c14-11-6-4-8-2-1-3-9-12(15)7-5-10(11)13(8)9/h1-7H.
What are the key properties of CID 101224795?
CID 101224795 has a molecular weight of 195.20 g/mol, XLogP of 3.19, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 101224795 is sourced from PubChem (CID 101224795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).