6-hydroxy-3,4-dihydro-2H-naphthalen-1-one

C10H10O2 — CID 4679494

IUPAC6-hydroxy-3,4-dihydro-2H-naphthalen-1-one
SMILESO=C1CCCc2cc(O)ccc21
InChIInChI=1S/C10H10O2/c11-8-4-5-9-7(6-8)2-1-3-10(9)12/h4-6,11H,1-3H2
InChIKeyFNSQPQKPPGALFA-UHFFFAOYSA-N
MW162.19 g/mol
LogP1.91
Rot. Bonds

About 6-hydroxy-3,4-dihydro-2H-naphthalen-1-one

6-hydroxy-3,4-dihydro-2H-naphthalen-1-one (PubChem CID 4679494) has the molecular formula C10H10O2 and a molecular weight of 162.19 g/mol. Its IUPAC name is 6-hydroxy-3,4-dihydro-2H-naphthalen-1-one.

Molecular Properties

Compound Name6-hydroxy-3,4-dihydro-2H-naphthalen-1-one
PubChem CID4679494
Molecular FormulaC10H10O2
Molecular Weight162.19 g/mol
Exact Mass162.07
IUPAC Name6-hydroxy-3,4-dihydro-2H-naphthalen-1-one
SMILESO=C1CCCc2cc(O)ccc21
InChIInChI=1S/C10H10O2/c11-8-4-5-9-7(6-8)2-1-3-10(9)12/h4-6,11H,1-3H2
InChIKeyFNSQPQKPPGALFA-UHFFFAOYSA-N
XLogP1.91
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.19
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-3,4-dihydro-2H-naphthalen-1-one?
The IUPAC name of 6-hydroxy-3,4-dihydro-2H-naphthalen-1-one (CID 4679494) is 6-hydroxy-3,4-dihydro-2H-naphthalen-1-one.
What is the SMILES notation for 6-hydroxy-3,4-dihydro-2H-naphthalen-1-one?
The canonical SMILES for 6-hydroxy-3,4-dihydro-2H-naphthalen-1-one is O=C1CCCc2cc(O)ccc21.
What is the InChIKey of 6-hydroxy-3,4-dihydro-2H-naphthalen-1-one?
The InChIKey is FNSQPQKPPGALFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10O2/c11-8-4-5-9-7(6-8)2-1-3-10(9)12/h4-6,11H,1-3H2.
What are the key properties of 6-hydroxy-3,4-dihydro-2H-naphthalen-1-one?
6-hydroxy-3,4-dihydro-2H-naphthalen-1-one has a molecular weight of 162.19 g/mol, XLogP of 1.91, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-3,4-dihydro-2H-naphthalen-1-one is sourced from PubChem (CID 4679494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).