(2-methylcyclopentyl)methanesulfonyl chloride

C7H13ClO2S — CID 84667340

IUPAC(2-methylcyclopentyl)methanesulfonyl chloride
SMILESCC1CCCC1CS(=O)(=O)Cl
InChIInChI=1S/C7H13ClO2S/c1-6-3-2-4-7(6)5-11(8,9)10/h6-7H,2-5H2,1H3
InChIKeyRIOXHVHSPYOXRG-UHFFFAOYSA-N
MW196.70 g/mol
LogP1.99
Rot. Bonds2

About (2-methylcyclopentyl)methanesulfonyl chloride

(2-methylcyclopentyl)methanesulfonyl chloride (PubChem CID 84667340) has the molecular formula C7H13ClO2S and a molecular weight of 196.70 g/mol. Its IUPAC name is (2-methylcyclopentyl)methanesulfonyl chloride.

Molecular Properties

Compound Name(2-methylcyclopentyl)methanesulfonyl chloride
PubChem CID84667340
Molecular FormulaC7H13ClO2S
Molecular Weight196.70 g/mol
Exact Mass196.03
IUPAC Name(2-methylcyclopentyl)methanesulfonyl chloride
SMILESCC1CCCC1CS(=O)(=O)Cl
InChIInChI=1S/C7H13ClO2S/c1-6-3-2-4-7(6)5-11(8,9)10/h6-7H,2-5H2,1H3
InChIKeyRIOXHVHSPYOXRG-UHFFFAOYSA-N
XLogP1.99
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.70
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-methylcyclopentyl)methanesulfonyl chloride?
The IUPAC name of (2-methylcyclopentyl)methanesulfonyl chloride (CID 84667340) is (2-methylcyclopentyl)methanesulfonyl chloride.
What is the SMILES notation for (2-methylcyclopentyl)methanesulfonyl chloride?
The canonical SMILES for (2-methylcyclopentyl)methanesulfonyl chloride is CC1CCCC1CS(=O)(=O)Cl.
What is the InChIKey of (2-methylcyclopentyl)methanesulfonyl chloride?
The InChIKey is RIOXHVHSPYOXRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13ClO2S/c1-6-3-2-4-7(6)5-11(8,9)10/h6-7H,2-5H2,1H3.
What are the key properties of (2-methylcyclopentyl)methanesulfonyl chloride?
(2-methylcyclopentyl)methanesulfonyl chloride has a molecular weight of 196.70 g/mol, XLogP of 1.99, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylcyclopentyl)methanesulfonyl chloride is sourced from PubChem (CID 84667340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).