3-(3,4-Dichlorophenyl)propionic acid
Properties
- Molecular formula
- C9H8Cl2O2
- Molar mass
- 219.06 g/mol
- Exact mass
- 217.9901 Da
- logP
- 3.01Crippen estimate
- Polar surface area
- 37.3 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 3
Hazards
Warning
- H302 Harmful if swallowed95% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H400 Very toxic to aquatic life95% of notifiers
- H410 Very toxic to aquatic life with long lasting effects95% of notifiers
Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P264, P264+P265, P270, P273, P280, P301+P317, P305+P351+P338, P330, P337+P317, P391, P501
Identifiers
CAS number
25173-68-6SMILES
C1=CC(=C(C=C1CCC(=O)O)Cl)ClInChIKey
NHYJRLYFKZYPMO-UHFFFAOYSA-NInChI
InChI=1S/C9H8Cl2O2/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1,3,5H,2,4H2,(H,12,13)Weigh it out
Type any one amount. The others follow from the molar mass.
Work with 3-(3,4-Dichlorophenyl)propionic acid
Similar compounds
15-(3,4-Dichlorophenyl)pentadecanoic acid116409-73-577 % similar
3,4-Dichlorophenylacetic acid5807-30-770 % similar
1,4-Benzenedipropanoic acid4251-21-266 % similar
3-(4-Chlorophenyl)propanoic acid2019-34-364 % similar
3-(3-Chlorophenyl)propanoic acid21640-48-261 % similar
Dihydrocaffeic acid1078-61-158 % similar
3-(2-Chlorophenyl)propionic acid1643-28-358 % similar
(βR)-β-Amino-3,4-dichlorobenzenebutanoic acid269396-55-657 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds