2,6,10-trihydroxy-10H-anthracen-9-one

C14H10O4 — CID 143428486

IUPAC2,6,10-trihydroxy-10H-anthracen-9-one
SMILESO=C1c2cc(O)ccc2C(O)c2cc(O)ccc21
InChIInChI=1S/C14H10O4/c15-7-1-3-9-11(5-7)14(18)10-4-2-8(16)6-12(10)13(9)17/h1-6,13,15-17H
InChIKeyYFHNOVONVCFLGX-UHFFFAOYSA-N
MW242.23 g/mol
LogP1.72
Rot. Bonds

About 2,6,10-trihydroxy-10H-anthracen-9-one

2,6,10-trihydroxy-10H-anthracen-9-one (PubChem CID 143428486) has the molecular formula C14H10O4 and a molecular weight of 242.23 g/mol. Its IUPAC name is 2,6,10-trihydroxy-10H-anthracen-9-one.

Molecular Properties

Compound Name2,6,10-trihydroxy-10H-anthracen-9-one
PubChem CID143428486
Molecular FormulaC14H10O4
Molecular Weight242.23 g/mol
Exact Mass242.06
IUPAC Name2,6,10-trihydroxy-10H-anthracen-9-one
SMILESO=C1c2cc(O)ccc2C(O)c2cc(O)ccc21
InChIInChI=1S/C14H10O4/c15-7-1-3-9-11(5-7)14(18)10-4-2-8(16)6-12(10)13(9)17/h1-6,13,15-17H
InChIKeyYFHNOVONVCFLGX-UHFFFAOYSA-N
XLogP1.72
TPSA77.76 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.23
LogP ≤ 51.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,6,10-trihydroxy-10H-anthracen-9-one?
The IUPAC name of 2,6,10-trihydroxy-10H-anthracen-9-one (CID 143428486) is 2,6,10-trihydroxy-10H-anthracen-9-one.
What is the SMILES notation for 2,6,10-trihydroxy-10H-anthracen-9-one?
The canonical SMILES for 2,6,10-trihydroxy-10H-anthracen-9-one is O=C1c2cc(O)ccc2C(O)c2cc(O)ccc21.
What is the InChIKey of 2,6,10-trihydroxy-10H-anthracen-9-one?
The InChIKey is YFHNOVONVCFLGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10O4/c15-7-1-3-9-11(5-7)14(18)10-4-2-8(16)6-12(10)13(9)17/h1-6,13,15-17H.
What are the key properties of 2,6,10-trihydroxy-10H-anthracen-9-one?
2,6,10-trihydroxy-10H-anthracen-9-one has a molecular weight of 242.23 g/mol, XLogP of 1.72, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6,10-trihydroxy-10H-anthracen-9-one is sourced from PubChem (CID 143428486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).