cyclopropanesulfonyl bromide

C3H5BrO2S — CID 22935856

IUPACcyclopropanesulfonyl bromide
SMILESO=S(=O)(Br)C1CC1
InChIInChI=1S/C3H5BrO2S/c4-7(5,6)3-1-2-3/h3H,1-2H2
InChIKeyQCYSWALXKOJEOK-UHFFFAOYSA-N
MW185.04 g/mol
LogP0.87
Rot. Bonds1

About cyclopropanesulfonyl bromide

cyclopropanesulfonyl bromide (PubChem CID 22935856) has the molecular formula C3H5BrO2S and a molecular weight of 185.04 g/mol. Its IUPAC name is cyclopropanesulfonyl bromide.

Molecular Properties

Compound Namecyclopropanesulfonyl bromide
PubChem CID22935856
Molecular FormulaC3H5BrO2S
Molecular Weight185.04 g/mol
Exact Mass183.92
IUPAC Namecyclopropanesulfonyl bromide
SMILESO=S(=O)(Br)C1CC1
InChIInChI=1S/C3H5BrO2S/c4-7(5,6)3-1-2-3/h3H,1-2H2
InChIKeyQCYSWALXKOJEOK-UHFFFAOYSA-N
XLogP0.87
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.04
LogP ≤ 50.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclopropanesulfonyl bromide?
The IUPAC name of cyclopropanesulfonyl bromide (CID 22935856) is cyclopropanesulfonyl bromide.
What is the SMILES notation for cyclopropanesulfonyl bromide?
The canonical SMILES for cyclopropanesulfonyl bromide is O=S(=O)(Br)C1CC1.
What is the InChIKey of cyclopropanesulfonyl bromide?
The InChIKey is QCYSWALXKOJEOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5BrO2S/c4-7(5,6)3-1-2-3/h3H,1-2H2.
What are the key properties of cyclopropanesulfonyl bromide?
cyclopropanesulfonyl bromide has a molecular weight of 185.04 g/mol, XLogP of 0.87, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropanesulfonyl bromide is sourced from PubChem (CID 22935856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).