3-Bromo-1H-pyrazol-5-amine
Properties
- Molecular formula
- C3H4BrN3
- Molar mass
- 161.99 g/mol
- Exact mass
- 160.9589 Da
- logP
- 0.75Crippen estimate
- Polar surface area
- 54.7 Ų
- H-bond donors / acceptors
- 2 / 2
- Rotatable bonds
- 0
Hazards
Danger
- H301 Toxic if swallowed20% of notifiers
- H302 Harmful if swallowed60% of notifiers
- H311 Toxic in contact with skin20% of notifiers
- H314 Causes severe skin burns and eye damage20% of notifiers
- H315 Causes skin irritation60% of notifiers
- H318 Causes serious eye damage20% of notifiers
- H319 Causes serious eye irritation60% of notifiers
- H331 Toxic if inhaled20% of notifiers
- H335 May cause respiratory irritation60% of notifiers
Aggregated from 5 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P260, P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P363, P403+P233, P405, P501
Identifiers
CAS number
950739-21-6SMILES
C1=C(NN=C1N)BrInChIKey
VGBYIGUWAWHQOT-UHFFFAOYSA-NInChI
InChI=1S/C3H4BrN3/c4-2-1-3(5)7-6-2/h1H,(H3,5,6,7)Weigh it out
Type any one amount. The others follow from the molar mass.
Work with 3-Bromo-1H-pyrazol-5-amine
Similar compounds
3-Cyclopropyl-1H-pyrazol-5-amine175137-46-943 % similar
5-Amino-3-ethyl-1H-pyrazole1904-24-143 % similar
3-Amino-5-phenylpyrazole827-41-842 % similar
5-Bromo-1H-pyrazole-3-carboxylic acid1328893-16-841 % similar
3-Amino-5-cyclobutyl-1H-pyrazole326827-21-841 % similar
3-(4-Chlorophenyl)-1H-pyrazol-5-amine78583-81-038 % similar
3-(2-Furyl)-1H-pyrazol-5-amine96799-02-937 % similar
5-Thien-2-yl-1H-pyrazol-3-amine96799-03-037 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.