cyclopentyl thiohypobromite

C5H9BrS — CID 117036067

IUPACcyclopentyl thiohypobromite
SMILESBrSC1CCCC1
InChIInChI=1S/C5H9BrS/c6-7-5-3-1-2-4-5/h5H,1-4H2
InChIKeyKGBPSGAMOTTYCI-UHFFFAOYSA-N
MW181.10 g/mol
LogP2.97
Rot. Bonds1

About cyclopentyl thiohypobromite

cyclopentyl thiohypobromite (PubChem CID 117036067) has the molecular formula C5H9BrS and a molecular weight of 181.10 g/mol. Its IUPAC name is cyclopentyl thiohypobromite.

Molecular Properties

Compound Namecyclopentyl thiohypobromite
PubChem CID117036067
Molecular FormulaC5H9BrS
Molecular Weight181.10 g/mol
Exact Mass179.96
IUPAC Namecyclopentyl thiohypobromite
SMILESBrSC1CCCC1
InChIInChI=1S/C5H9BrS/c6-7-5-3-1-2-4-5/h5H,1-4H2
InChIKeyKGBPSGAMOTTYCI-UHFFFAOYSA-N
XLogP2.97
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.10
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Cyclopentanethiol
CID 15510
Disulfanylcyclopentane
CID 19832725
Lithium cyclopentanethiolate
CID 20660853
Cyclopentyl thiohypochlorite
CID 22755049
Sodium cyclopentanethiolate
CID 57665350
Cyclopentyl thiohypoiodite
CID 89955994
Trisulfanylcyclopentane
CID 141499006

Frequently Asked Questions

What is the IUPAC name of cyclopentyl thiohypobromite?
The IUPAC name of cyclopentyl thiohypobromite (CID 117036067) is cyclopentyl thiohypobromite.
What is the SMILES notation for cyclopentyl thiohypobromite?
The canonical SMILES for cyclopentyl thiohypobromite is BrSC1CCCC1.
What is the InChIKey of cyclopentyl thiohypobromite?
The InChIKey is KGBPSGAMOTTYCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9BrS/c6-7-5-3-1-2-4-5/h5H,1-4H2.
What are the key properties of cyclopentyl thiohypobromite?
cyclopentyl thiohypobromite has a molecular weight of 181.10 g/mol, XLogP of 2.97, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl thiohypobromite is sourced from PubChem (CID 117036067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).