Benzocaine
Properties
- Molecular formula
- C9H11NO2
- Molar mass
- 165.19 g/mol
- Exact mass
- 165.0790 Da
- Melting point
- 92 °C
- Boiling point
- 310 °C
- pKa
- 2.51 (conjugate acid)
- Water solubility
- 1.31 g/L (25 °C)
- logP
- 1.45Crippen estimate
- Polar surface area
- 52.3 Ų
- H-bond donors / acceptors
- 1 / 3
- Rotatable bonds
- 2
Hazards
Danger
- H317 May cause an allergic skin reaction77.8% of notifiers
- H370 Causes damage to organs47.3% of notifiers
- H411 Toxic to aquatic life with long lasting effects11.4% of notifiers
Aggregated from 351 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P260, P261, P264, P270, P272, P273, P280, P302+P352, P308+P316, P321, P333+P317, P362+P364, P391, P405, P501
Identifiers
CAS number
94-09-7SMILES
CCOC(=O)c1ccc(N)cc1InChIKey
BLFLLBZGZJTVJG-UHFFFAOYSA-NInChI
InChI=1S/C9H11NO2/c1-2-12-9(11)7-3-5-8(10)6-4-7/h3-6H,2,10H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
46 names · show all
- Benzoic acid, 4-amino-, ethyl ester
- Benzoic acid, p-amino-, ethyl ester
- p-Aminobenzoic acid ethyl ester
- Anaesthesin
- Anesthesin
- Anesthesine
- Anesthone
- Ethyl p-aminobenzoate
- Ethyl 4-aminobenzoate
- Keloform
- Norcain
- Norcaine
- Orthesin
- Parathesin
- p-Ethoxycarboxylic aniline
- Amben ethyl ester
- Ethyl p-aminophenylcarboxylate
- p-Carbethoxyaniline
- 4-Aminobenzoic acid ethyl ester
- 4-Carbethoxyaniline
- p-(Ethoxycarbonyl)aniline
- Ethyl aminobenzoate
- 4-(Ethoxycarbonyl)aniline
- Anestezin
- Parathesine
- Identhesin
- Anaesthan-syngala
- Solu H
- Ora-jel
- Anaesthin
- Ethoform
- Ethyl p-aminobenzenecarboxylate
- (p-(Ethoxycarbonyl)phenylamine
- 4-(Ethoxycarbonyl)phenylamine
- Slim mint gum
- Diet ayds
- Americaine
- Orabase-B
- Baby anbesol
- Aethoform
- NSC 41531
- NSC 4688
- Benzoak
- Gingicaine
- Anbesol
- Et-PABA
Reactions
Work with Benzocaine
Predict the NMR spectrum1H and 13C shifts with multiplicities
Make a solutionWhat to weigh for any molarity and volume
Check drug-likenessLipinski, Veber and lead-likeness
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
Benzocaine hydrochloride23239-88-590 % similar
Diethyl terephthalate636-09-978 % similar
Risocaine94-12-270 % similar
Ethyl 3-aminobenzoate582-33-266 % similar
Butyl 4-aminobenzoate94-25-766 % similar
Trimethylene glycol di-P-aminobenzoate57609-64-066 % similar
Ethyl 4-methylbenzoate94-08-666 % similar
Ethyl benzoate93-89-065 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds