naphthalene-2-sulfonyl chloride

C10H7ClO2S — CID 7125

IUPACnaphthalene-2-sulfonyl chloride
SMILESO=S(=O)(Cl)c1ccc2ccccc2c1
InChIInChI=1S/C10H7ClO2S/c11-14(12,13)10-6-5-8-3-1-2-4-9(8)7-10/h1-7H
InChIKeyOPECTNGATDYLSS-UHFFFAOYSA-N
MW226.68 g/mol
LogP2.77
Rot. Bonds1

About naphthalene-2-sulfonyl chloride

naphthalene-2-sulfonyl chloride (PubChem CID 7125) has the molecular formula C10H7ClO2S and a molecular weight of 226.68 g/mol. Its IUPAC name is naphthalene-2-sulfonyl chloride.

Molecular Properties

Compound Namenaphthalene-2-sulfonyl chloride
PubChem CID7125
Molecular FormulaC10H7ClO2S
Molecular Weight226.68 g/mol
Exact Mass225.99
IUPAC Namenaphthalene-2-sulfonyl chloride
SMILESO=S(=O)(Cl)c1ccc2ccccc2c1
InChIInChI=1S/C10H7ClO2S/c11-14(12,13)10-6-5-8-3-1-2-4-9(8)7-10/h1-7H
InChIKeyOPECTNGATDYLSS-UHFFFAOYSA-N
XLogP2.77
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.68
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of naphthalene-2-sulfonyl chloride?
The IUPAC name of naphthalene-2-sulfonyl chloride (CID 7125) is naphthalene-2-sulfonyl chloride.
What is the SMILES notation for naphthalene-2-sulfonyl chloride?
The canonical SMILES for naphthalene-2-sulfonyl chloride is O=S(=O)(Cl)c1ccc2ccccc2c1.
What is the InChIKey of naphthalene-2-sulfonyl chloride?
The InChIKey is OPECTNGATDYLSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7ClO2S/c11-14(12,13)10-6-5-8-3-1-2-4-9(8)7-10/h1-7H.
What are the key properties of naphthalene-2-sulfonyl chloride?
naphthalene-2-sulfonyl chloride has a molecular weight of 226.68 g/mol, XLogP of 2.77, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for naphthalene-2-sulfonyl chloride is sourced from PubChem (CID 7125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).