1-naphthalen-1-ylsulfonylnaphthalene

C20H14O2S — CID 853912

IUPAC1-naphthalen-1-ylsulfonylnaphthalene
SMILESO=S(=O)(c1cccc2ccccc12)c1cccc2ccccc12
InChIInChI=1S/C20H14O2S/c21-23(22,19-13-5-9-15-7-1-3-11-17(15)19)20-14-6-10-16-8-2-4-12-18(16)20/h1-14H
InChIKeyAEKZEKVVJXLCSI-UHFFFAOYSA-N
MW318.40 g/mol
LogP4.83
Rot. Bonds2

About 1-naphthalen-1-ylsulfonylnaphthalene

1-naphthalen-1-ylsulfonylnaphthalene (PubChem CID 853912) has the molecular formula C20H14O2S and a molecular weight of 318.40 g/mol. Its IUPAC name is 1-naphthalen-1-ylsulfonylnaphthalene.

Molecular Properties

Compound Name1-naphthalen-1-ylsulfonylnaphthalene
PubChem CID853912
Molecular FormulaC20H14O2S
Molecular Weight318.40 g/mol
Exact Mass318.07
IUPAC Name1-naphthalen-1-ylsulfonylnaphthalene
SMILESO=S(=O)(c1cccc2ccccc12)c1cccc2ccccc12
InChIInChI=1S/C20H14O2S/c21-23(22,19-13-5-9-15-7-1-3-11-17(15)19)20-14-6-10-16-8-2-4-12-18(16)20/h1-14H
InChIKeyAEKZEKVVJXLCSI-UHFFFAOYSA-N
XLogP4.83
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.40
LogP ≤ 54.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-1-ylsulfonylnaphthalene?
The IUPAC name of 1-naphthalen-1-ylsulfonylnaphthalene (CID 853912) is 1-naphthalen-1-ylsulfonylnaphthalene.
What is the SMILES notation for 1-naphthalen-1-ylsulfonylnaphthalene?
The canonical SMILES for 1-naphthalen-1-ylsulfonylnaphthalene is O=S(=O)(c1cccc2ccccc12)c1cccc2ccccc12.
What is the InChIKey of 1-naphthalen-1-ylsulfonylnaphthalene?
The InChIKey is AEKZEKVVJXLCSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14O2S/c21-23(22,19-13-5-9-15-7-1-3-11-17(15)19)20-14-6-10-16-8-2-4-12-18(16)20/h1-14H.
What are the key properties of 1-naphthalen-1-ylsulfonylnaphthalene?
1-naphthalen-1-ylsulfonylnaphthalene has a molecular weight of 318.40 g/mol, XLogP of 4.83, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-1-ylsulfonylnaphthalene is sourced from PubChem (CID 853912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).