Propylparaben
Properties
- Molecular formula
- C10H12O3
- Molar mass
- 180.20 g/mol
- Exact mass
- 180.0786 Da
- Density
- 1.063 g/mL (at 102 °C)
- Melting point
- 96–97 °C
- Boiling point
- 102–105 °C
- logP
- 1.96Crippen estimate
- Polar surface area
- 46.5 Ų
- H-bond donors / acceptors
- 1 / 3
- Rotatable bonds
- 3
Identifiers
CAS number
94-13-3SMILES
CCCOC(=O)c1ccc(O)cc1InChIKey
QELSKZZBTMNZEB-UHFFFAOYSA-NInChI
InChI=1S/C10H12O3/c1-2-7-13-10(12)8-3-5-9(11)6-4-8/h3-6,11H,2,7H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
33 names · show all
- Benzoic acid, 4-hydroxy-, propyl ester
- Aseptoform P
- Bonomold OP
- p-Hydroxybenzoic acid propyl ester
- Nipasol
- Paseptol
- Preserval P
- Propyl chemosept
- Nipasol M
- Propylparasept
- Tegosept P
- n-Propyl 4-hydroxybenzoate
- Propyl 4-hydroxybenzoate
- Pulvis conservans
- p-Hydroxybenzoic propyl ester
- 4-Hydroxybenzoic acid propyl ester
- Chemocide PK
- Propagin
- Propyl butex
- Solbrol P
- Nipazol
- Nipagin P
- Nipasol P
- Propyl p-hydroxybenzoate
- n-Propylparaben
- Mekkings P
- NSC 23515
- NSC 8511
- Propyl p-oxybenzoate
- Paraben P
- Tegasept P
- Paratexin P
- Benzoic acid, p-hydroxy-, propyl ester
Work with Propylparaben
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
Butylparaben94-26-882 % similar
Pentyl P-hydroxybenzoate6521-29-579 % similar
Hexyl 4-hydroxybenzoate1083-27-877 % similar
Heptylparaben1085-12-777 % similar
Octyl P-hydroxybenzoate1219-38-177 % similar
Dodecyl 4-hydroxybenzoate2664-60-077 % similar
Ethylparaben120-47-870 % similar
Propyl benzoate2315-68-667 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds