2-Chlororesorcinol

C6H5ClO2CAS 6201-65-6144.55 g/mol

Open in Covalent MOL file
HOOHCl
Aryl halidePhenol

Properties

Molecular formula
C6H5ClO2
Molar mass
144.55 g/mol
Exact mass
143.9978 Da
Melting point
97–98 °C
logP
1.75Crippen estimate
Polar surface area
40.5 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
0

Hazards

Danger
Corrosive (GHS05)Irritant (GHS07)

Aggregated from 40 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+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
6201-65-6
SMILES
Oc1cccc(O)c1Cl
InChIKey
SWZVJOLLQTWFCW-UHFFFAOYSA-N
InChI
InChI=1S/C6H5ClO2/c7-6-4(8)2-1-3-5(6)9/h1-3,8-9H

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Type any one amount. The others follow from the molar mass.

Names and synonyms

5 names
  • 1,3-Benzenediol, 2-chloro-
  • Resorcinol, 2-chloro-
  • 2-Chloro-1,3-benzenediol
  • 2-Chloro-1,3-dihydroxybenzene
  • 2-Chlororesorcin

Work with 2-Chlororesorcinol

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,3-Dichlorophenol576-24-970 % similar 3-Bromo-2-chlorophenol863870-87-567 % similar 2-Chloro-3-fluorophenol863870-86-464 % similar 2-Chloro-3-(trifluoromethyl)phenol138377-34-156 % similar 2,3,4-Trichlorophenol15950-66-055 % similar Catechol120-80-953 % similar 1,5-Dihydroxynaphthalene83-56-753 % similar Pyrogallol87-66-153 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

5-Methylfuran-2-carbonyl chloride14003-11-3 4-Chlorocatechol2138-22-9 Chlorohydroquinone615-67-8 4-Chlororesorcinol95-88-5

Elsewhere

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