Ethyl 3,5-dichloro-4-hydroxybenzoate
Properties
- Molecular formula
- C9H8Cl2O3
- Molar mass
- 235.06 g/mol
- Exact mass
- 233.9850 Da
- Melting point
- 111–112 °C
- logP
- 2.88Crippen estimate
- Polar surface area
- 46.5 Ų
- H-bond donors / acceptors
- 1 / 3
- Rotatable bonds
- 2
Hazards
Warning
- H302+H312+H332 Harmful if swallowed, in contact with skin or if inhaled25% of notifiers
- H302 Harmful if swallowed37.5% of notifiers
- H312 Harmful in contact with skin37.5% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H332 Harmful if inhaled37.5% of notifiers
- H335 May cause respiratory irritation62.5% of notifiers
Aggregated from 8 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
17302-82-8SMILES
CCOC(=O)c1cc(Cl)c(O)c(Cl)c1InChIKey
WMKNGSJJEMFQOT-UHFFFAOYSA-NInChI
InChI=1S/C9H8Cl2O3/c1-2-14-9(13)5-3-6(10)8(12)7(11)4-5/h3-4,12H,2H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
4 names
- Benzoic acid, 3,5-dichloro-4-hydroxy-, ethyl ester
- Ethyl 4-hydroxy-3,5-dichlorobenzoate
- 3,5-Dichloro-4-hydroxybenzoic acid ethyl ester
- NSC 74473
Work with Ethyl 3,5-dichloro-4-hydroxybenzoate
Similar compounds
Ethyl gallate831-61-867 % similar
Methyl 3,5-dichloro-4-hydroxybenzoate3337-59-564 % similar
Triethyl 1,3,5-benzenetricarboxylate4105-92-463 % similar
Ethyl 3,5-dichlorobenzoate91085-56-261 % similar
1,3-Diethyl 1,3-benzenedicarboxylate636-53-356 % similar
Ethyl 3-hydroxybenzoate7781-98-855 % similar
Ethyl protocatechuate3943-89-354 % similar
Ethyl o-chlorobenzoate7335-25-354 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.