(1-methylcyclobutyl)methanesulfinyl chloride

C6H11ClOS — CID 165460099

IUPAC(1-methylcyclobutyl)methanesulfinyl chloride
SMILESCC1(CS(=O)Cl)CCC1
InChIInChI=1S/C6H11ClOS/c1-6(3-2-4-6)5-9(7)8/h2-5H2,1H3
InChIKeyJXSDCXBCEBTPOB-UHFFFAOYSA-N
MW166.67 g/mol
LogP2.08
Rot. Bonds2

About (1-methylcyclobutyl)methanesulfinyl chloride

(1-methylcyclobutyl)methanesulfinyl chloride (PubChem CID 165460099) has the molecular formula C6H11ClOS and a molecular weight of 166.67 g/mol. Its IUPAC name is (1-methylcyclobutyl)methanesulfinyl chloride.

Molecular Properties

Compound Name(1-methylcyclobutyl)methanesulfinyl chloride
PubChem CID165460099
Molecular FormulaC6H11ClOS
Molecular Weight166.67 g/mol
Exact Mass166.02
IUPAC Name(1-methylcyclobutyl)methanesulfinyl chloride
SMILESCC1(CS(=O)Cl)CCC1
InChIInChI=1S/C6H11ClOS/c1-6(3-2-4-6)5-9(7)8/h2-5H2,1H3
InChIKeyJXSDCXBCEBTPOB-UHFFFAOYSA-N
XLogP2.08
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.67
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(1-cyanocyclobutyl)methanesulfinyl chloride
CID 165452706
1-[4-[(1-methylcyclobutyl)methyl]cyclohexyl]ethanone
CID 130192513
(1-cyanocyclohexyl)methanesulfinyl chloride
CID 165452705
[1-(trifluoromethyl)cyclopropyl]methanesulfinyl chloride
CID 165461488
2-(1-methylcyclobutyl)ethanamine;hydrochloride
CID 55284653
1-chloro-1-methylcyclotridecane
CID 71082065
3-(1-methylcyclobutyl)propanenitrile
CID 59843558
N,N-dimethyl-2-(1-methylcyclobutyl)ethanamine;ethane
CID 144987666
sodium (4-methyloxan-4-yl)methanesulfinate
CID 165449192
(2,2-difluoro-3,3-dimethylcyclopropyl)methanesulfinyl chloride
CID 165452888
2-chloro-N-[(1-methylcyclobutyl)methyl]ethanamine
CID 130601571
2,2,3,3-tetramethyl-N-[(1-methylcyclobutyl)methyl]cyclopropan-1-amine
CID 130601051

Frequently Asked Questions

What is the IUPAC name of (1-methylcyclobutyl)methanesulfinyl chloride?
The IUPAC name of (1-methylcyclobutyl)methanesulfinyl chloride (CID 165460099) is (1-methylcyclobutyl)methanesulfinyl chloride.
What is the SMILES notation for (1-methylcyclobutyl)methanesulfinyl chloride?
The canonical SMILES for (1-methylcyclobutyl)methanesulfinyl chloride is CC1(CS(=O)Cl)CCC1.
What is the InChIKey of (1-methylcyclobutyl)methanesulfinyl chloride?
The InChIKey is JXSDCXBCEBTPOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11ClOS/c1-6(3-2-4-6)5-9(7)8/h2-5H2,1H3.
What are the key properties of (1-methylcyclobutyl)methanesulfinyl chloride?
(1-methylcyclobutyl)methanesulfinyl chloride has a molecular weight of 166.67 g/mol, XLogP of 2.08, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylcyclobutyl)methanesulfinyl chloride is sourced from PubChem (CID 165460099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).