4H-naphthalen-4a-ol

C10H10O — CID 20847521

IUPAC4H-naphthalen-4a-ol
SMILESOC12C=CC=CC1=CC=CC2
InChIInChI=1S/C10H10O/c11-10-7-3-1-5-9(10)6-2-4-8-10/h1-7,11H,8H2
InChIKeyCKFYOKZUDLOSQW-UHFFFAOYSA-N
MW146.19 g/mol
LogP1.73
Rot. Bonds

About 4H-naphthalen-4a-ol

4H-naphthalen-4a-ol (PubChem CID 20847521) has the molecular formula C10H10O and a molecular weight of 146.19 g/mol. Its IUPAC name is 4H-naphthalen-4a-ol.

Molecular Properties

Compound Name4H-naphthalen-4a-ol
PubChem CID20847521
Molecular FormulaC10H10O
Molecular Weight146.19 g/mol
Exact Mass146.07
IUPAC Name4H-naphthalen-4a-ol
SMILESOC12C=CC=CC1=CC=CC2
InChIInChI=1S/C10H10O/c11-10-7-3-1-5-9(10)6-2-4-8-10/h1-7,11H,8H2
InChIKeyCKFYOKZUDLOSQW-UHFFFAOYSA-N
XLogP1.73
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4H-naphthalen-4a-ol?
The IUPAC name of 4H-naphthalen-4a-ol (CID 20847521) is 4H-naphthalen-4a-ol.
What is the SMILES notation for 4H-naphthalen-4a-ol?
The canonical SMILES for 4H-naphthalen-4a-ol is OC12C=CC=CC1=CC=CC2.
What is the InChIKey of 4H-naphthalen-4a-ol?
The InChIKey is CKFYOKZUDLOSQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10O/c11-10-7-3-1-5-9(10)6-2-4-8-10/h1-7,11H,8H2.
What are the key properties of 4H-naphthalen-4a-ol?
4H-naphthalen-4a-ol has a molecular weight of 146.19 g/mol, XLogP of 1.73, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4H-naphthalen-4a-ol is sourced from PubChem (CID 20847521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).