Chemical Properties of 1H-Tetrazole-5-thiol, 1-phenyl- (CAS 86-93-1)

InChI

InChI=1S/C7H6N4S/c12-7-8-9-10-11(7)6-4-2-1-3-5-6/h1-5H,(H,8,10,12)

InChI Key

GGZHVNZHFYCSEV-UHFFFAOYSA-N

Formula

C7H6N4S

SMILES

Sc1nnnn1-c1ccccc1

Molecular Weight¹

178.21

CAS

86-93-1

Other Names

• Mercaptophenyltetrazole
• Phenylmercaptotetrazole
• 1-Phenyl-5-mercaptotetrazole
• 1-Phenyl-5-tetrazolethione
• 1-Phenyltetrazole-5-thiol
• 1-Phenyltetrazolethiol
• 5-Mercapto-1-phenyltetrazol
• 5-Mercapto-1-phenyltetrazole
• 1-Phenyl-1H-tetrazole-5-thiol
• 5-Mercapto-1-phenyl-1,2,3,4-tetrazole
• 1-Phenyl-5-mercapto-1,2,3,4-tetrazole
• 1-Phenyl-5-mercapto-1H-tetrazole
• 1,2,3,4-Tetrazole-5-thiol, 1-phenyl-
• 1-Phenyltetrazoline-5-thione
• 2-Tetrazoline-5-thione, 1-phenyl-
• 5H-Tetrazole-5-thione, 1,2-dihydro-1-phenyl-
• NSC 24018

• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Similar Compounds

Find more compounds similar to 1H-Tetrazole-5-thiol, 1-phenyl-.

Sources

• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

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