CID 172835203

C5H10LiS — CID 172835203

IUPAC—
SMILESSC1CCCC1.[Li]
InChIInChI=1S/C5H10S.Li/c6-5-3-1-2-4-5;/h5-6H,1-4H2;
InChIKeyWBBZLADPLNNVGT-UHFFFAOYSA-N
MW109.14 g/mol
LogP1.48
Rot. Bonds

About CID 172835203

CID 172835203 (PubChem CID 172835203) has the molecular formula C5H10LiS and a molecular weight of 109.14 g/mol.

Molecular Properties

Compound NameCID 172835203
PubChem CID172835203
Molecular FormulaC5H10LiS
Molecular Weight109.14 g/mol
Exact Mass109.07
IUPAC Name—
SMILESSC1CCCC1.[Li]
InChIInChI=1S/C5H10S.Li/c6-5-3-1-2-4-5;/h5-6H,1-4H2;
InChIKeyWBBZLADPLNNVGT-UHFFFAOYSA-N
XLogP1.48
TPSA0.00 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.14
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Cyclopentanethiol
CID 15510
1,2-Dimercaptocyclopentane
CID 12371414
3-Fluorocyclopentane-1-thiol
CID 23290228
trans-(1R,2R)-cyclopentane-1,2-dithiol
CID 12371415
Lithium cyclopentanethiolate
CID 20660853
Cyclopentanethiol;tris(yttrium)
CID 59743201
Cyclopentane-1,3-dithiol
CID 87063724
Copper;cyclopentanethiol
CID 88391040
cis-(1R,3S)-cyclopentane-1,3-dithiol
CID 130279587
Cyclopentane-1,1,2-trithiol
CID 141308098
Cyclopentanethiol;ethane
CID 141914277
3-Sulfanylcyclopentane-1-thione
CID 141930319

Frequently Asked Questions

What is the IUPAC name of CID 172835203?
The IUPAC name of CID 172835203 (CID 172835203) is not available.
What is the SMILES notation for CID 172835203?
The canonical SMILES for CID 172835203 is SC1CCCC1.[Li].
What is the InChIKey of CID 172835203?
The InChIKey is WBBZLADPLNNVGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10S.Li/c6-5-3-1-2-4-5;/h5-6H,1-4H2;.
What are the key properties of CID 172835203?
CID 172835203 has a molecular weight of 109.14 g/mol, XLogP of 1.48, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 172835203 is sourced from PubChem (CID 172835203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).