Benzocaine

Chemical Information
Benzocaine is a benzoate ester having 4-aminobenzoic acid as the acid component and ethanol as the alcohol component. A surface anaesthetic, it is used to suppress the gag reflex, and as a lubricant and topical anaesthetic on the larynx, mouth, nasal cavity, respiratory tract, oesophagus, rectum, urinary tract, and vagina. It has a role as a sensitiser, a topical anaesthetic, an allergen and an antipruritic drug. It is a benzoate ester and a substituted aniline.
| CAS Number | 94-09-7 |
| PubChem CID | 2337 |
| IUPAC Name | ethyl 4-aminobenzoate |
| Molecular Formula | C9H11NO2 |
| Molecular Weight | 165.19 |
| XLogP | 1.9 |
| Topological Polar Surface Area | 52.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 151 |
| Property | Value |
|---|---|
| Molecular Weight | 165.19 |
| XLogP3 | 1.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 165.078978594 |
| Monoisotopic Mass | 165.078978594 |
| Topological Polar Surface Area | 52.3 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 151 |
| 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 |
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