4-methylnaphthalene-1-sulfinyl chloride

C11H9ClOS — CID 143542500

IUPAC4-methylnaphthalene-1-sulfinyl chloride
SMILESCc1ccc(S(=O)Cl)c2ccccc12
InChIInChI=1S/C11H9ClOS/c1-8-6-7-11(14(12)13)10-5-3-2-4-9(8)10/h2-7H,1H3
InChIKeyZMMNFUANLFOHHA-UHFFFAOYSA-N
MW224.71 g/mol
LogP3.41
Rot. Bonds1

About 4-methylnaphthalene-1-sulfinyl chloride

4-methylnaphthalene-1-sulfinyl chloride (PubChem CID 143542500) has the molecular formula C11H9ClOS and a molecular weight of 224.71 g/mol. Its IUPAC name is 4-methylnaphthalene-1-sulfinyl chloride.

Molecular Properties

Compound Name4-methylnaphthalene-1-sulfinyl chloride
PubChem CID143542500
Molecular FormulaC11H9ClOS
Molecular Weight224.71 g/mol
Exact Mass224.01
IUPAC Name4-methylnaphthalene-1-sulfinyl chloride
SMILESCc1ccc(S(=O)Cl)c2ccccc12
InChIInChI=1S/C11H9ClOS/c1-8-6-7-11(14(12)13)10-5-3-2-4-9(8)10/h2-7H,1H3
InChIKeyZMMNFUANLFOHHA-UHFFFAOYSA-N
XLogP3.41
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.71
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-methylnaphthalene-1-sulfinyl chloride?
The IUPAC name of 4-methylnaphthalene-1-sulfinyl chloride (CID 143542500) is 4-methylnaphthalene-1-sulfinyl chloride.
What is the SMILES notation for 4-methylnaphthalene-1-sulfinyl chloride?
The canonical SMILES for 4-methylnaphthalene-1-sulfinyl chloride is Cc1ccc(S(=O)Cl)c2ccccc12.
What is the InChIKey of 4-methylnaphthalene-1-sulfinyl chloride?
The InChIKey is ZMMNFUANLFOHHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClOS/c1-8-6-7-11(14(12)13)10-5-3-2-4-9(8)10/h2-7H,1H3.
What are the key properties of 4-methylnaphthalene-1-sulfinyl chloride?
4-methylnaphthalene-1-sulfinyl chloride has a molecular weight of 224.71 g/mol, XLogP of 3.41, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylnaphthalene-1-sulfinyl chloride is sourced from PubChem (CID 143542500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).