1,6-dibromonaphthalen-2-ol;sulfur dioxide

C10H6Br2O3S — CID 70231756

IUPAC1,6-dibromonaphthalen-2-ol;sulfur dioxide
SMILESO=S=O.Oc1ccc2cc(Br)ccc2c1Br
InChIInChI=1S/C10H6Br2O.O2S/c11-7-2-3-8-6(5-7)1-4-9(13)10(8)12;1-3-2/h1-5,13H;
InChIKeyYFXWGMHWCTZJQF-UHFFFAOYSA-N
MW366.03 g/mol
LogP3.40
Rot. Bonds

About 1,6-dibromonaphthalen-2-ol;sulfur dioxide

1,6-dibromonaphthalen-2-ol;sulfur dioxide (PubChem CID 70231756) has the molecular formula C10H6Br2O3S and a molecular weight of 366.03 g/mol. Its IUPAC name is 1,6-dibromonaphthalen-2-ol;sulfur dioxide.

Molecular Properties

Compound Name1,6-dibromonaphthalen-2-ol;sulfur dioxide
PubChem CID70231756
Molecular FormulaC10H6Br2O3S
Molecular Weight366.03 g/mol
Exact Mass363.84
IUPAC Name1,6-dibromonaphthalen-2-ol;sulfur dioxide
SMILESO=S=O.Oc1ccc2cc(Br)ccc2c1Br
InChIInChI=1S/C10H6Br2O.O2S/c11-7-2-3-8-6(5-7)1-4-9(13)10(8)12;1-3-2/h1-5,13H;
InChIKeyYFXWGMHWCTZJQF-UHFFFAOYSA-N
XLogP3.40
TPSA54.37 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.03
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,6-dibromonaphthalen-2-ol;sulfur dioxide?
The IUPAC name of 1,6-dibromonaphthalen-2-ol;sulfur dioxide (CID 70231756) is 1,6-dibromonaphthalen-2-ol;sulfur dioxide.
What is the SMILES notation for 1,6-dibromonaphthalen-2-ol;sulfur dioxide?
The canonical SMILES for 1,6-dibromonaphthalen-2-ol;sulfur dioxide is O=S=O.Oc1ccc2cc(Br)ccc2c1Br.
What is the InChIKey of 1,6-dibromonaphthalen-2-ol;sulfur dioxide?
The InChIKey is YFXWGMHWCTZJQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Br2O.O2S/c11-7-2-3-8-6(5-7)1-4-9(13)10(8)12;1-3-2/h1-5,13H;.
What are the key properties of 1,6-dibromonaphthalen-2-ol;sulfur dioxide?
1,6-dibromonaphthalen-2-ol;sulfur dioxide has a molecular weight of 366.03 g/mol, XLogP of 3.40, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,6-dibromonaphthalen-2-ol;sulfur dioxide is sourced from PubChem (CID 70231756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).