123333-53-9
Product Name:
1-Hydroxybenzotriazole hydrate
Formula:
C6H7N3O2
Synonyms:
HOBt Hydrate
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CHEMICAL AND PHYSICAL PROPERTIES
| Chemical Classes | Nitrogen Compounds -> Triazoles |
|---|
SAFETY INFORMATION
| Signal word | Danger |
|---|---|
| Pictogram(s) |
 Flame Flammables GHS02  Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H319:Serious eye damage/eye irritation H412:Hazardous to the aquatic environment, long-term hazard |
| Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P230:Keep wetted with … P233:Keep container tightly closed. P280:Wear protective gloves/protective clothing/eye protection/face protection. P370+P380+P375:in case of fire: Evacuate area. Fight fire remotely due to the risk of explosion. P501:Dispose of contents/container to..… |
COMPUTED DESCRIPTORS
| Molecular Weight | 153.14 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 0 |
| Exact Mass | 153.053826475 g/mol |
| Monoisotopic Mass | 153.053826475 g/mol |
| Topological Polar Surface Area | 51.9 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 130 |
| 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 | 2 |
| Compound Is Canonicalized | Yes |