CID 24848567

C18H11O+ — CID 24848567

IUPAC—
SMILESO[C@@H]1[CH+]c2ccc3ccc4cccc5cc1c2c3c45
InChIInChI=1S/C18H11O/c19-15-9-13-7-6-11-5-4-10-2-1-3-12-8-14(15)17(13)18(11)16(10)12/h1-9,15,19H/q+1/t15-/m1/s1
InChIKeyBWXQDPGJZSTFCR-OAHLLOKOSA-N
MW243.28 g/mol
LogP4.18
Rot. Bonds

About CID 24848567

CID 24848567 (PubChem CID 24848567) has the molecular formula C18H11O+ and a molecular weight of 243.28 g/mol.

Molecular Properties

Compound NameCID 24848567
PubChem CID24848567
Molecular FormulaC18H11O+
Molecular Weight243.28 g/mol
Exact Mass243.08
IUPAC Name—
SMILESO[C@@H]1[CH+]c2ccc3ccc4cccc5cc1c2c3c45
InChIInChI=1S/C18H11O/c19-15-9-13-7-6-11-5-4-10-2-1-3-12-8-14(15)17(13)18(11)16(10)12/h1-9,15,19H/q+1/t15-/m1/s1
InChIKeyBWXQDPGJZSTFCR-OAHLLOKOSA-N
XLogP4.18
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.28
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 24848567?
The IUPAC name of CID 24848567 (CID 24848567) is not available.
What is the SMILES notation for CID 24848567?
The canonical SMILES for CID 24848567 is O[C@@H]1[CH+]c2ccc3ccc4cccc5cc1c2c3c45.
What is the InChIKey of CID 24848567?
The InChIKey is BWXQDPGJZSTFCR-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H11O/c19-15-9-13-7-6-11-5-4-10-2-1-3-12-8-14(15)17(13)18(11)16(10)12/h1-9,15,19H/q+1/t15-/m1/s1.
What are the key properties of CID 24848567?
CID 24848567 has a molecular weight of 243.28 g/mol, XLogP of 4.18, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 24848567 is sourced from PubChem (CID 24848567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).