Benzyl nitrite
benzyl nitrite
Also Known As: Benzyl nitrite|benzylnitrite|Benzylnitrit|Phenylmethyl nitrite|Nitrousacidbenzylester|Nitrous acid benzyl ester|Nitrous acid, benzyl ester|Nitrous acid, phenylmethyl ester
CAS: 935-05-7
| Molecular Formula | C1=CC=C(C=C1)CON=O |
|---|---|
| Molecular Weight | 137.04768 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 137.04768 |
| Monoisotopic Mass | 137.04768 |
| Heavy Atoms | 10 |
| Complexity | 99.0 |
Chemical Identifiers
| CAS Number | 935-05-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)CON=O |
| InChIKey | IYYGLLJDALWAMD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Agrochemicals (2 patents)
Catalysts (25 patents)
Construction Chemicals (1 patents)
Heterocyclic Building Blocks (65 patents)
Lubricants & Additives (1 patents)
Organic Building Blocks (78 patents)
Organometallic Reagents (3 patents)
Pharmaceutical Intermediates (27 patents)
Plastic Additives (2 patents)
Polymer Intermediates (1 patents)
Product Overview
Benzyl nitrite (CAS 935-05-7), with molecular formula C1=CC=C(C=C1)CON=O and molecular weight 137.04768 g/mol. IUPAC: benzyl nitrite.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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