CAS 65550-78-9 2-Bromo-5-iodo-3-methylpyridine (HCID 10108680)

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Basic information

CAS: 65550-78-9
Standard SMILES: Cc1cc(I)cnc1Br
InChIKey: WJPSANINUBHCFE-UHFFFAOYSA-N
Molecular formula: C6H5BrIN
Average molar mass: 297.92 g/mol
Monoisotopic mass: 296.86500926

Names & identifiers

Preferred name: 2-Bromo-5-iodo-3-methylpyridine
IUPAC: 2-bromo-5-iodo-3-methylpyridine
English name: 2-Bromo-5-iodo-3-methylpyridine
Molecular formula: C6H5BrIN
Molecular weight: 297.92

Names & synonyms

2-Bromo-5-iodo-3-methylpyridine65550-78-9DTXSID40435791RefChem:257359DTXCID80386617678-919-72-Bromo-5-iodo-3-picolineMFCD090374662-bromo-5-iodo-3-methyl-pyridinePyridine, 2-bromo-5-iodo-3-methyl-SCHEMBL1929811AKOS015891658

Show more names

2-Bromo-5-iodo-3-methylpyridne2-Bromo-3-methyl-5-iodopyridine2-Bromo-5-iodo-3-methylpyridine >2-Bromo-5-iodo-3-methylpyridine 98%2-BROMO-5-IODO-3-METHYLPYRIDINE ISO 9001：2015 REACH

SY041758B4312CS-01531752-Bromo-5-iSCHEMBL30938606DS-11870DB-082200I10151

Database identifiers

CAS: 65550-78-9
PubChem CID: 10108680
DTXSID: DTXSID40435791
EC Number: 678-919-7

Properties

Computed structural properties

XLogP: 2.9
Topological polar surface area: 12.9 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 0
Heavy atoms: 9
Formal charge: 0
Complexity: 99.1

Physicochemical properties

Melting point: 43 · 43-46°C
Boiling point: 298 ℃ · 298℃
Density: 2.171 · 2.171
Flash point: 134 ℃ · 134℃
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
solubility: soluble in Methanol
form: powder to crystal
pka: -0.94 · -0.94±0.20(Predicted)
color: White to Orange to Green
λmax: 275 nm · 275nm(lit.)
Sensitive: Light Sensitive
Symbol(GHS): 6 · GHS06
Signal word: Warning
Hazard statements: 301 · H301-H315-H319-H335
Precautionary statements: 261 · P261-P280a-P301+P310a-P305+P351+P338-P405-P501a
Risk Statements: 22 · 22-36/37/38

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (80%): Harmful if swallowed [Warning Acute toxicity, oral]

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

Aggregated GHS information provided per 5 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.