86-93-1
Product Name:
1-Phenyltetrazole-5-thiol
Formula:
C7H6N4S
Synonyms:
1-Phenyl-5-mercaptotetrazole;1-Phenyltetrazoline-5-thione;5-Mercapto-1-phenyltetrazole
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CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | White odorless crystalline powder; [Alfa Aesar MSDS] |
|---|---|
| Chemical Classes | Nitrogen Compounds -> Other Nitrogen Rings |
SAFETY INFORMATION
| Signal word | Danger |
|---|---|
| Pictogram(s) |
 Flame Flammables GHS02  Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H228:Flammable solids H317:Sensitisation, Skin H319:Serious eye damage/eye irritation H413:Hazardous to the aquatic environment, long-term hazard |
| Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P240:Ground/bond container and receiving equipment. P273:Avoid release to the environment. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of soap and water. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
COMPUTED DESCRIPTORS
| Molecular Weight | 178.22 g/mol |
|---|---|
| XLogP3 | 2.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 178.03131738 g/mol |
| Monoisotopic Mass | 178.03131738 g/mol |
| Topological Polar Surface Area | 72.1 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 210 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
1-Phenyl-5-mercaptotetrazole is a member of tetrazoles.