Ethylparaben
Properties
- Molecular formula
- C9H10O3
- Molar mass
- 166.18 g/mol
- Exact mass
- 166.0630 Da
- Melting point
- 116 °C
- Boiling point
- 297.5 °C
- pKa
- 8.34
- logP
- 1.57Crippen estimate
- Polar surface area
- 46.5 Ų
- H-bond donors / acceptors
- 1 / 3
- Rotatable bonds
- 2
Hazards
Danger
- H304 May be fatal if swallowed and enters airways33.5% of notifiers
- H315 Causes skin irritation38.8% of notifiers
- H317 May cause an allergic skin reaction34% of notifiers
- H319 Causes serious eye irritation39.3% of notifiers
Aggregated from 1,336 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P272, P280, P301+P316, P302+P352, P305+P351+P338, P321, P331, P332+P317, P333+P317, P337+P317, P362+P364, P405, P501
Identifiers
CAS number
120-47-8SMILES
CCOC(=O)c1ccc(O)cc1InChIKey
NUVBSKCKDOMJSU-UHFFFAOYSA-NInChI
InChI=1S/C9H10O3/c1-2-12-9(11)7-3-5-8(10)6-4-7/h3-6,10H,2H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
33 names · show all
- Nipazin A
- Benzoic acid, 4-hydroxy-, ethyl ester
- Benzoic acid, p-hydroxy-, ethyl ester
- Aseptoform E
- Bonomold OE
- p-Carbethoxyphenol
- Easeptol
- Ethyl p-hydroxybenzoate
- Ethyl parasept
- p-Hydroxybenzoic acid ethyl ester
- Nipagin A
- Solbrol A
- Tegosept E
- Ethyl 4-hydroxybenzoate
- 4-Hydroxybenzoic acid ethyl ester
- p-(Ethoxycarbonyl)phenol
- Napagin A
- Sobrol A
- Ethyl butex
- Mycocten
- p-Hydroxybenzoate ethyl ester
- 4-(Ethoxycarbonyl)phenol
- 4-Carbethoxyphenol
- Aseptine A
- Aseptin A
- Mekkings E
- Ethyl nipagin
- NSC 23514
- NSC 8510
- E 214
- 4-Hydroxybenzoic ethyl ester
- Ethyl parahydroxybenzoate
- Ethyparaben
Work with Ethylparaben
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
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
Diethyl terephthalate636-09-978 % similar
Diethyl 4,4'-biphenyldicarboxylate47230-38-670 % similar
Propylparaben94-13-370 % similar
Ethyl 4-bromobenzoate5798-75-469 % similar
Ethyl 3-hydroxybenzoate7781-98-866 % similar
Butylparaben94-26-866 % similar
Ethyl 4-methylbenzoate94-08-666 % similar
Ethyl protocatechuate3943-89-365 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.