[(1R,2R)-2-(trifluoromethyl)cyclobutyl]methanesulfonyl chloride

C6H8ClF3O2S — CID 155820610

IUPAC[(1R,2R)-2-(trifluoromethyl)cyclobutyl]methanesulfonyl chloride
SMILESO=S(=O)(Cl)C[C@@H]1CC[C@H]1C(F)(F)F
InChIInChI=1S/C6H8ClF3O2S/c7-13(11,12)3-4-1-2-5(4)6(8,9)10/h4-5H,1-3H2/t4-,5+/m0/s1
InChIKeyVAWCIRVHSYNQNP-CRCLSJGQSA-N
MW236.64 g/mol
LogP2.14
Rot. Bonds2

About [(1R,2R)-2-(trifluoromethyl)cyclobutyl]methanesulfonyl chloride

[(1R,2R)-2-(trifluoromethyl)cyclobutyl]methanesulfonyl chloride (PubChem CID 155820610) has the molecular formula C6H8ClF3O2S and a molecular weight of 236.64 g/mol. Its IUPAC name is [(1R,2R)-2-(trifluoromethyl)cyclobutyl]methanesulfonyl chloride.

Molecular Properties

Compound Name[(1R,2R)-2-(trifluoromethyl)cyclobutyl]methanesulfonyl chloride
PubChem CID155820610
Molecular FormulaC6H8ClF3O2S
Molecular Weight236.64 g/mol
Exact Mass235.99
IUPAC Name[(1R,2R)-2-(trifluoromethyl)cyclobutyl]methanesulfonyl chloride
SMILESO=S(=O)(Cl)C[C@@H]1CC[C@H]1C(F)(F)F
InChIInChI=1S/C6H8ClF3O2S/c7-13(11,12)3-4-1-2-5(4)6(8,9)10/h4-5H,1-3H2/t4-,5+/m0/s1
InChIKeyVAWCIRVHSYNQNP-CRCLSJGQSA-N
XLogP2.14
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.64
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze [(1R,2R)-2-(trifluoromethyl)cyclobutyl]methanesulfonyl chloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-Cyclobutylethane-1-sulfonyl chloride
CID 84071545
(3,3-Difluorocyclobutyl)methanesulfonyl chloride
CID 90355675
3-(Difluoromethyl)cyclobutane-1-sulfonyl chloride
CID 118868806
(3-Fluorocyclobutyl)methanesulfonyl chloride
CID 126688657
3-(Trifluoromethyl)cyclobutane-1-sulfonyl chloride
CID 131196495
2-Ethyl-4,4,4-trifluorobutane-1-sulfonyl chloride
CID 132427836
2-Ethyl-4,4-difluorobutane-1-sulfonyl chloride
CID 137698809
{2,2-Difluorospiro[2.3]hexan-1-yl}methanesulfonyl chloride
CID 138039572
(1-(2,2-Difluoroethyl)cyclobutyl)methanesulfonyl chloride
CID 138040584
[3-(Trifluoromethyl)cyclobutyl]methanesulfonyl chloride
CID 138987509
2-(3,3-Difluorocyclobutyl)ethane-1-sulfonyl chloride
CID 154578276
3-(Fluoromethyl)cyclobutane-1-sulfonyl chloride
CID 165947738

Frequently Asked Questions

What is the IUPAC name of [(1R,2R)-2-(trifluoromethyl)cyclobutyl]methanesulfonyl chloride?
The IUPAC name of [(1R,2R)-2-(trifluoromethyl)cyclobutyl]methanesulfonyl chloride (CID 155820610) is [(1R,2R)-2-(trifluoromethyl)cyclobutyl]methanesulfonyl chloride.
What is the SMILES notation for [(1R,2R)-2-(trifluoromethyl)cyclobutyl]methanesulfonyl chloride?
The canonical SMILES for [(1R,2R)-2-(trifluoromethyl)cyclobutyl]methanesulfonyl chloride is O=S(=O)(Cl)C[C@@H]1CC[C@H]1C(F)(F)F.
What is the InChIKey of [(1R,2R)-2-(trifluoromethyl)cyclobutyl]methanesulfonyl chloride?
The InChIKey is VAWCIRVHSYNQNP-CRCLSJGQSA-N. The full InChI is InChI=1S/C6H8ClF3O2S/c7-13(11,12)3-4-1-2-5(4)6(8,9)10/h4-5H,1-3H2/t4-,5+/m0/s1.
What are the key properties of [(1R,2R)-2-(trifluoromethyl)cyclobutyl]methanesulfonyl chloride?
[(1R,2R)-2-(trifluoromethyl)cyclobutyl]methanesulfonyl chloride has a molecular weight of 236.64 g/mol, XLogP of 2.14, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,2R)-2-(trifluoromethyl)cyclobutyl]methanesulfonyl chloride is sourced from PubChem (CID 155820610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).