CID 59792618

C5H3ClS — CID 59792618

IUPAC—
SMILES[CH]c1sccc1Cl
InChIInChI=1S/C5H3ClS/c1-4-5(6)2-3-7-4/h1-3H
InChIKeyVSTWBDQSXJRNNA-UHFFFAOYSA-N
MW130.60 g/mol
LogP2.46
Rot. Bonds

About CID 59792618

CID 59792618 (PubChem CID 59792618) has the molecular formula C5H3ClS and a molecular weight of 130.60 g/mol.

Molecular Properties

Compound NameCID 59792618
PubChem CID59792618
Molecular FormulaC5H3ClS
Molecular Weight130.60 g/mol
Exact Mass129.96
IUPAC Name—
SMILES[CH]c1sccc1Cl
InChIInChI=1S/C5H3ClS/c1-4-5(6)2-3-7-4/h1-3H
InChIKeyVSTWBDQSXJRNNA-UHFFFAOYSA-N
XLogP2.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.60
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 59792618?
The IUPAC name of CID 59792618 (CID 59792618) is not available.
What is the SMILES notation for CID 59792618?
The canonical SMILES for CID 59792618 is [CH]c1sccc1Cl.
What is the InChIKey of CID 59792618?
The InChIKey is VSTWBDQSXJRNNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H3ClS/c1-4-5(6)2-3-7-4/h1-3H.
What are the key properties of CID 59792618?
CID 59792618 has a molecular weight of 130.60 g/mol, XLogP of 2.46, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59792618 is sourced from PubChem (CID 59792618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).