5-sulfonaphthalene-2-diazonium

C10H7N2O3S+ — CID 71444489

IUPAC5-sulfonaphthalene-2-diazonium
SMILESN#[N+]c1ccc2c(S(=O)(=O)O)cccc2c1
InChIInChI=1S/C10H6N2O3S/c11-12-8-4-5-9-7(6-8)2-1-3-10(9)16(13,14)15/h1-6H/p+1
InChIKeyKAUBTSVXGINYPX-UHFFFAOYSA-O
MW235.24 g/mol
LogP2.57
Rot. Bonds1

About 5-sulfonaphthalene-2-diazonium

5-sulfonaphthalene-2-diazonium (PubChem CID 71444489) has the molecular formula C10H7N2O3S+ and a molecular weight of 235.24 g/mol. Its IUPAC name is 5-sulfonaphthalene-2-diazonium.

Molecular Properties

Compound Name5-sulfonaphthalene-2-diazonium
PubChem CID71444489
Molecular FormulaC10H7N2O3S+
Molecular Weight235.24 g/mol
Exact Mass235.02
IUPAC Name5-sulfonaphthalene-2-diazonium
SMILESN#[N+]c1ccc2c(S(=O)(=O)O)cccc2c1
InChIInChI=1S/C10H6N2O3S/c11-12-8-4-5-9-7(6-8)2-1-3-10(9)16(13,14)15/h1-6H/p+1
InChIKeyKAUBTSVXGINYPX-UHFFFAOYSA-O
XLogP2.57
TPSA82.52 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.24
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Azo_group', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

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Related Compounds

5-hydroxynaphthalene-2-diazonium
CID 20577618
naphthalene-1-sulfonic acid
CID 158712346
1,6-NAPHTHALENEDISULFONIC ACID, DISODIUM SALT DIHYDRATE
CID 126960168
5-carboxynaphthalene-2-diazonium
CID 155817948
methanamine;naphthalene-1-sulfonic acid
CID 174421353
CID 87877281
CID 87877281
aluminum naphthalene-1-sulfonic acid
CID 19753639
lithium;hydride;naphthalene-1-sulfonic acid;hydrate
CID 173436914
potassium;hydride;naphthalene-1-sulfonic acid
CID 173036389
CID 87599032
CID 87599032
anthracene-1-sulfonic acid;hydrofluoride
CID 174515955
disodium;hydride;naphthalene-1-sulfonic acid;sulfuric acid
CID 174856610

Frequently Asked Questions

What is the IUPAC name of 5-sulfonaphthalene-2-diazonium?
The IUPAC name of 5-sulfonaphthalene-2-diazonium (CID 71444489) is 5-sulfonaphthalene-2-diazonium.
What is the SMILES notation for 5-sulfonaphthalene-2-diazonium?
The canonical SMILES for 5-sulfonaphthalene-2-diazonium is N#[N+]c1ccc2c(S(=O)(=O)O)cccc2c1.
What is the InChIKey of 5-sulfonaphthalene-2-diazonium?
The InChIKey is KAUBTSVXGINYPX-UHFFFAOYSA-O. The full InChI is InChI=1S/C10H6N2O3S/c11-12-8-4-5-9-7(6-8)2-1-3-10(9)16(13,14)15/h1-6H/p+1.
What are the key properties of 5-sulfonaphthalene-2-diazonium?
5-sulfonaphthalene-2-diazonium has a molecular weight of 235.24 g/mol, XLogP of 2.57, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-sulfonaphthalene-2-diazonium is sourced from PubChem (CID 71444489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).