5-Chloro-1H-indazole

C7H5ClN2CAS 698-26-0152.58 g/mol

Open in Covalent MOL file
ClNHN
Aryl halide

Properties

Molecular formula
C7H5ClN2
Molar mass
152.58 g/mol
Exact mass
152.0141 Da
Melting point
119–120 °C
logP
2.22Crippen estimate
Polar surface area
28.7 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 2 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, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
698-26-0
SMILES
Clc1ccc2[nH]ncc2c1
InChIKey
FVNCILPDWNBPLK-UHFFFAOYSA-N
InChI
InChI=1S/C7H5ClN2/c8-6-1-2-7-5(3-6)4-9-10-7/h1-4H,(H,9,10)

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Names and synonyms

3 names
  • 1H-Indazole, 5-chloro-
  • 5-Chloroindazole
  • NSC 78434

Work with 5-Chloro-1H-indazole

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

5-Fluoro-1H-indazole348-26-560 % similar 1H-Indazol-5-ol15579-15-455 % similar 5-Methyl-1H-indazole1776-37-055 % similar 1H-Indazol-5-amine19335-11-655 % similar 5-Bromo-1H-indazole53857-57-155 % similar 5-Iodo-1H-indazole55919-82-955 % similar 1H-Indazole-5-boronic acid338454-14-152 % similar 1H-Indazole-5-carboxaldehyde253801-04-650 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Chloro-3-pyridineacetonitrile101012-32-2 6-Chloro-1H-pyrrolo[3,2-b]pyridine1021339-19-4 4-Chloro (1H)indazole13096-96-3 5-Chloro-1H-pyrrolo[2,3-C]pyridine131084-55-4 6-Chloromethyl-2-cyanopyridine135450-23-6 4-Amino-2-chlorobenzonitrile20925-27-3 4-Amino-3-chlorobenzonitrile21803-75-8 2-Chloro-6-methyl-3-pyridinecarbonitrile28900-10-9

Elsewhere

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