CAS 933034-94-7 4-Bromo-6-chloro-5-methylpyridazin-3-amine (HCID 59624331)

Substructure search Find similar structures

Basic information

CAS: 933034-94-7
Standard SMILES: Cc1c(Cl)nnc(N)c1Br
InChIKey: ZLYWLRPISFPECU-UHFFFAOYSA-N
Molecular formula: C5H5BrClN3
Average molar mass: 222.47 g/mol
Monoisotopic mass: 220.93554

Names & identifiers

Preferred name: 4-Bromo-6-chloro-5-methylpyridazin-3-amine
IUPAC: 4-bromo-6-chloro-5-methylpyridazin-3-amine
English name: 4-bromo-6-chloro-5-methylpyridazin-3-amine
Molecular formula: C5H5BrClN3
Molecular weight: 222.47

Names & synonyms

4-bromo-6-chloro-5-methylpyridazin-3-amine933034-94-7RefChem:520248995-290-73-Pyridazinamine, 4-bromo-6-chloro-5-methyl-SCHEMBL3016544ZLYWLRPISFPECU-UHFFFAOYSA-NIMB03494MFCD27933450DB-2059304-Bromo-6-chloro-5-methyl-3-pyridazinamine3-Pyridazinamine,4-bromo-6-chloro-5-methyl-

Show more names

4-bromo-6-chloro-5-methyl-pyridazin-3-amineF80752F983153

Database identifiers

CAS: 933034-94-7
PubChem CID: 59624331
EC Number: 995-290-7

Properties

Computed structural properties

XLogP: 1.5
Topological polar surface area: 51.8 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 0
Heavy atoms: 10
Formal charge: 0
Complexity: 123

Physicochemical properties

Boiling point: 385.1 · 385.1±37.0 °C(Predicted)
Density: 1.815 · 1.815±0.06 g/cm3(Predicted)
storage temp.: 2 · 2-8°C, sealed storage, away from moisture and light
pka: 2.85 · 2.85±0.10(Predicted)
Appearance: Off-white to yellow Solid

Safety & regulation

GHS classification

GHS Classification · 5 items

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.