1-Chloro-4-ethoxybenzene
Properties
- Molecular formula
- C8H9ClO
- Molar mass
- 156.61 g/mol
- Exact mass
- 156.0342 Da
- Melting point
- 21 °C
- Boiling point
- 213 °C
- logP
- 2.74Crippen estimate
- Polar surface area
- 9.2 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 2
Hazards
Warning
- H227 Combustible liquid100% of notifiers
- H302 Harmful if swallowed100% of notifiers
- H312 Harmful in contact with skin100% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H332 Harmful if inhaled100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, 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, P370+P378, P403, P403+P233, P405, P501
Identifiers
CAS number
622-61-7SMILES
CCOc1ccc(Cl)cc1InChIKey
IXLSVQMYQRAMEW-UHFFFAOYSA-NInChI
InChI=1S/C8H9ClO/c1-2-10-8-5-3-7(9)4-6-8/h3-6H,2H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
10 names
- Benzene, 1-chloro-4-ethoxy-
- Phenetole, p-chloro-
- p-Chlorophenetole
- 4-Chlorophenol ethyl ether
- p-Chlorophenyl ethyl ether
- p-Ethoxychlorobenzene
- 4-Chlorophenetole
- 4-Chloroethoxybenzene
- 4-Ethoxychlorobenzene
- NSC 6161
Work with 1-Chloro-4-ethoxybenzene
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
1,4-Diethoxybenzene122-95-271 % similar
Bis(p-chlorophenoxy)methane555-89-563 % similar
1-Chloro-4-(2-chloroethoxy)benzene13001-28-059 % similar
Alpha,4-Dichloroanisole21151-56-458 % similar
2-(4-Chlorophenoxy)ethanol1892-43-957 % similar
1-(2-Bromoethoxy)-4-chlorobenzene2033-76-357 % similar
Ethyl phenyl ether103-73-156 % similar
P-Phenetidine156-43-456 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.
Same formula
4-Chloro-2,6-dimethylphenol1123-63-3
(1R)-1-(3-Chlorophenyl)ethanol120121-01-9
(1R)-1-(2-Chlorophenyl)ethan-1-ol120466-66-2
(S)-1-(2-Chlorophenyl)ethanol131864-71-6
1-Chloro-4-methoxy-2-methylbenzene13334-71-9
(1S)-1-(3-Chlorophenyl)ethan-1-ol135145-34-5
1-(2-Chlorophenyl)ethanol13524-04-4
4-Chloro-3-ethylphenol14143-32-9