3012-37-1
Product Name:
Benzyl thiocyanate
Formula:
C8H7NS
Synonyms:
Benzyl rhodanide;Benzyl thiocyanate;Thiocyanic acid benzyl ester, Benzyl rhodanide
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CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Solid |
|---|---|
| Melting Point | 41 - 42 °C |
| LogP | 1.99 |
| Kovats Retention Index | 1339 1313 |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H412:Hazardous to the aquatic environment, long-term hazard |
| Precautionary Statement Codes |
P273:Avoid release to the environment. P280:Wear protective gloves/protective clothing/eye protection/face protection. |
COMPUTED DESCRIPTORS
| Molecular Weight | 149.21 g/mol |
|---|---|
| XLogP3 | 2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 149.02992040 g/mol |
| Monoisotopic Mass | 149.02992040 g/mol |
| Topological Polar Surface Area | 49.1 Ų |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 129 |
| 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
Benzyl thiocyanate is a member of thiocyanates.