9,10-dihydroanthracen-10-ide

C14H11- — CID 15258421

IUPAC9,10-dihydroanthracen-10-ide
SMILESc1ccc2c(c1)[CH-]c1ccccc1C2
InChIInChI=1S/C14H11/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h1-9H,10H2/q-1
InChIKeyQYJBREXFMXWYJV-UHFFFAOYSA-N
MW179.24 g/mol
LogP3.19
Rot. Bonds

About 9,10-dihydroanthracen-10-ide

9,10-dihydroanthracen-10-ide (PubChem CID 15258421) has the molecular formula C14H11- and a molecular weight of 179.24 g/mol. Its IUPAC name is 9,10-dihydroanthracen-10-ide.

Molecular Properties

Compound Name9,10-dihydroanthracen-10-ide
PubChem CID15258421
Molecular FormulaC14H11-
Molecular Weight179.24 g/mol
Exact Mass179.09
IUPAC Name9,10-dihydroanthracen-10-ide
SMILESc1ccc2c(c1)[CH-]c1ccccc1C2
InChIInChI=1S/C14H11/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h1-9H,10H2/q-1
InChIKeyQYJBREXFMXWYJV-UHFFFAOYSA-N
XLogP3.19
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.24
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 9,10-dihydroanthracen-10-ide?
The IUPAC name of 9,10-dihydroanthracen-10-ide (CID 15258421) is 9,10-dihydroanthracen-10-ide.
What is the SMILES notation for 9,10-dihydroanthracen-10-ide?
The canonical SMILES for 9,10-dihydroanthracen-10-ide is c1ccc2c(c1)[CH-]c1ccccc1C2.
What is the InChIKey of 9,10-dihydroanthracen-10-ide?
The InChIKey is QYJBREXFMXWYJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h1-9H,10H2/q-1.
What are the key properties of 9,10-dihydroanthracen-10-ide?
9,10-dihydroanthracen-10-ide has a molecular weight of 179.24 g/mol, XLogP of 3.19, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9,10-dihydroanthracen-10-ide is sourced from PubChem (CID 15258421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).