10H-anthracen-9-one

C14H10O — CID 7018

IUPAC10H-anthracen-9-one
SMILESO=C1c2ccccc2Cc2ccccc21
InChIInChI=1S/C14H10O/c15-14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)14/h1-8H,9H2
InChIKeyRJGDLRCDCYRQOQ-UHFFFAOYSA-N
MW194.23 g/mol
LogP2.82
Rot. Bonds

About 10H-anthracen-9-one

10H-anthracen-9-one (PubChem CID 7018) has the molecular formula C14H10O and a molecular weight of 194.23 g/mol. Its IUPAC name is 10H-anthracen-9-one.

Molecular Properties

Compound Name10H-anthracen-9-one
PubChem CID7018
Molecular FormulaC14H10O
Molecular Weight194.23 g/mol
Exact Mass194.07
IUPAC Name10H-anthracen-9-one
SMILESO=C1c2ccccc2Cc2ccccc21
InChIInChI=1S/C14H10O/c15-14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)14/h1-8H,9H2
InChIKeyRJGDLRCDCYRQOQ-UHFFFAOYSA-N
XLogP2.82
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 10H-anthracen-9-one?
The IUPAC name of 10H-anthracen-9-one (CID 7018) is 10H-anthracen-9-one.
What is the SMILES notation for 10H-anthracen-9-one?
The canonical SMILES for 10H-anthracen-9-one is O=C1c2ccccc2Cc2ccccc21.
What is the InChIKey of 10H-anthracen-9-one?
The InChIKey is RJGDLRCDCYRQOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10O/c15-14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)14/h1-8H,9H2.
What are the key properties of 10H-anthracen-9-one?
10H-anthracen-9-one has a molecular weight of 194.23 g/mol, XLogP of 2.82, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10H-anthracen-9-one is sourced from PubChem (CID 7018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).