1,3-thiazol-2-ylarsane;hydrochloride

C3H5AsClNS — CID 173118306

IUPAC1,3-thiazol-2-ylarsane;hydrochloride
SMILESCl.[AsH2]c1nccs1
InChIInChI=1S/C3H4AsNS.ClH/c4-3-5-1-2-6-3;/h1-2H,4H2;1H
InChIKeyNFHVIDCXDVZLNT-UHFFFAOYSA-N
MW197.52 g/mol
LogP-0.18
Rot. Bonds

About 1,3-thiazol-2-ylarsane;hydrochloride

1,3-thiazol-2-ylarsane;hydrochloride (PubChem CID 173118306) has the molecular formula C3H5AsClNS and a molecular weight of 197.52 g/mol. Its IUPAC name is 1,3-thiazol-2-ylarsane;hydrochloride.

Molecular Properties

Compound Name1,3-thiazol-2-ylarsane;hydrochloride
PubChem CID173118306
Molecular FormulaC3H5AsClNS
Molecular Weight197.52 g/mol
Exact Mass196.90
IUPAC Name1,3-thiazol-2-ylarsane;hydrochloride
SMILESCl.[AsH2]c1nccs1
InChIInChI=1S/C3H4AsNS.ClH/c4-3-5-1-2-6-3;/h1-2H,4H2;1H
InChIKeyNFHVIDCXDVZLNT-UHFFFAOYSA-N
XLogP-0.18
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.52
LogP ≤ 5-0.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,3-thiazol-2-ylarsane;hydrochloride?
The IUPAC name of 1,3-thiazol-2-ylarsane;hydrochloride (CID 173118306) is 1,3-thiazol-2-ylarsane;hydrochloride.
What is the SMILES notation for 1,3-thiazol-2-ylarsane;hydrochloride?
The canonical SMILES for 1,3-thiazol-2-ylarsane;hydrochloride is Cl.[AsH2]c1nccs1.
What is the InChIKey of 1,3-thiazol-2-ylarsane;hydrochloride?
The InChIKey is NFHVIDCXDVZLNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4AsNS.ClH/c4-3-5-1-2-6-3;/h1-2H,4H2;1H.
What are the key properties of 1,3-thiazol-2-ylarsane;hydrochloride?
1,3-thiazol-2-ylarsane;hydrochloride has a molecular weight of 197.52 g/mol, XLogP of -0.18, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-thiazol-2-ylarsane;hydrochloride is sourced from PubChem (CID 173118306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).