4-Chloro-2-(1H-pyrazol-3-yl)phenol
Properties
- Molecular formula
- C9H7ClN2O
- Molar mass
- 194.62 g/mol
- Exact mass
- 194.0247 Da
- Melting point
- 150–152 °C
- logP
- 2.44Crippen estimate
- Polar surface area
- 48.9 Ų
- H-bond donors / acceptors
- 2 / 2
- Rotatable bonds
- 1
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation97.8% of notifiers
Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
18704-67-1SMILES
Oc1ccc(Cl)cc1-c1cc[nH]n1InChIKey
DMGLUMYOLOAXJY-UHFFFAOYSA-NInChI
InChI=1S/C9H7ClN2O/c10-6-1-2-9(13)7(5-6)8-3-4-11-12-8/h1-5,13H,(H,11,12)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
6 names
- Phenol, 4-chloro-2-(1H-pyrazol-3-yl)-
- Phenol, 4-chloro-2-pyrazol-3-yl-
- Phenol, 4-chloro-2-[pyrazol-3(or 5)-yl]-
- Mycanodin
- 4-Chloro-2-(3-pyrazolyl)phenol
- Kr 104
Work with 4-Chloro-2-(1H-pyrazol-3-yl)phenol
Similar compounds
4-Chlorocatechol2138-22-945 % similar
2,4-Dichlorophenol120-83-243 % similar
2,2'-Methylenebis(4-chlorophenol)1322-43-641 % similar
4-Chloro-2-methylphenol1570-64-541 % similar
4-Chloro-2-fluorophenol348-62-941 % similar
2-Bromo-4-chlorophenol695-96-541 % similar
4-Chloro-2-iodophenol71643-66-841 % similar
2-Amino-4-chlorophenol95-85-241 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.