trisulfanylcyclopentane

C5H10S3 — CID 141499006

IUPACtrisulfanylcyclopentane
SMILESSSSC1CCCC1
InChIInChI=1S/C5H10S3/c6-8-7-5-3-1-2-4-5/h5-6H,1-4H2
InChIKeyHPXZJDADXNAYOK-UHFFFAOYSA-N
MW166.34 g/mol
LogP3.16
Rot. Bonds2

About trisulfanylcyclopentane

trisulfanylcyclopentane (PubChem CID 141499006) has the molecular formula C5H10S3 and a molecular weight of 166.34 g/mol. Its IUPAC name is trisulfanylcyclopentane.

Molecular Properties

Compound Nametrisulfanylcyclopentane
PubChem CID141499006
Molecular FormulaC5H10S3
Molecular Weight166.34 g/mol
Exact Mass165.99
IUPAC Nametrisulfanylcyclopentane
SMILESSSSC1CCCC1
InChIInChI=1S/C5H10S3/c6-8-7-5-3-1-2-4-5/h5-6H,1-4H2
InChIKeyHPXZJDADXNAYOK-UHFFFAOYSA-N
XLogP3.16
TPSA0.00 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.34
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'disulphide', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Related Compounds

Cyclopentanethiol
CID 15510
1,2-Dimercaptocyclopentane
CID 12371414
(Propyldisulfanyl)cyclopentane
CID 10171282
trans-(1R,2R)-cyclopentane-1,2-dithiol
CID 12371415
Disulfanylcyclopentane
CID 19832725
Lithium cyclopentanethiolate
CID 20660853
Cyclopentyl thiohypochlorite
CID 22755049
2-Cyclopentylsulfanyl-1,3,2-dithiaphospholane
CID 53726376
Sodium cyclopentanethiolate
CID 57665350
Cyclopentane-1,3-dithiol
CID 87063724
(Methyldisulfanyl)cyclopentane
CID 87128146
(Ethyldisulfanyl)cyclopentane
CID 87128367

Frequently Asked Questions

What is the IUPAC name of trisulfanylcyclopentane?
The IUPAC name of trisulfanylcyclopentane (CID 141499006) is trisulfanylcyclopentane.
What is the SMILES notation for trisulfanylcyclopentane?
The canonical SMILES for trisulfanylcyclopentane is SSSC1CCCC1.
What is the InChIKey of trisulfanylcyclopentane?
The InChIKey is HPXZJDADXNAYOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10S3/c6-8-7-5-3-1-2-4-5/h5-6H,1-4H2.
What are the key properties of trisulfanylcyclopentane?
trisulfanylcyclopentane has a molecular weight of 166.34 g/mol, XLogP of 3.16, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trisulfanylcyclopentane is sourced from PubChem (CID 141499006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).