Basic information
- CAS
73290-22-9- Standard SMILES
Brc1ccc(I)cn1- InChIKey
LLKRSJVPTKFSLS-UHFFFAOYSA-N- Molecular formula
- C5H3BrIN
- Average molar mass
- 283.89 g/mol
- Monoisotopic mass
- 282.8493592
Names & identifiers
- Preferred name
- 2-Bromo-5-iodopyridine
- IUPAC
- 2-bromo-5-iodopyridine
- English name
- 2-Bromo-5-iodopyridine
- Molecular formula
- C5H3BrIN
- Molecular weight
- 283.89
Names & synonyms
2-Bromo-5-iodopyridine73290-22-9DTXSID00406189RefChem:257363DTXCID00357041629-182-52-Bromo-5-iodo-pyridineMFCD03095201Pyridine, 2-bromo-5-iodo-5-iodo-2-bromo-pyridineSCHEMBL5029332-Bromo-5-iodopyridine, 96%
Show more names
2-Bromo-5-Iodine Pyridine2-Bromo-5-iodopyridine 96%2-Bromo-5-iodopyridine,97%2-Bromo-5-iodopyridine >JR-6787, 2-Bromo-5-iodopyridine, 97%2-Bromo-5-iodopyridine ISO 9001：2015 REACH
CS-W003027HY-W003027AC-1094GS-6890EN300-88738FT-0650005orb2940053SCHEMBL29778088
Database identifiers
- CAS
73290-22-9- PubChem CID
- 4738271
- DTXSID
DTXSID00406189- EC Number
- 629-182-5
- Nikkaji
- J1.272.611B
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 78.8
Physicochemical properties
- Melting point
- 121 · 121-123 °C (lit.)
- Boiling point
- 278.6 · 278.6±20.0 °C(Predicted)
- Density
- 2.347 · 2.347±0.06 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- pka
- -1.23 · -1.23±0.10(Predicted)
- form
- Powder
- color
- White to off-white
- Sensitive
- Light Sensitive
- BRN
- 109100 · 109100
- InChI
- InChI=1S/C5H3BrIN/c6-5-2-1-4(7)3-8-5/h1-3H
- InChIKey
- LLKRSJVPTKFSLS-UHFFFAOYSA-N
- SMILES
- C1(Br)=NC=C(I)C=C1
- CAS DataBase Reference
- 73290 · 73290-22-9(CAS DataBase Reference)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 5 · GHS05,GHS07
- Signal word
- Danger
- Hazard statements
- 302 · H302-H315-H318-H335
- Precautionary statements
- 280 · P280-P301+P312+P330-P302+P352-P305+P351+P338+P310
- target organs
- Respiratory system
- PPE
- 95 · dust mask type N95 (US), Eyeshields, Gloves
- Hazard Codes
- Xn,Xi
- Risk Statements
- 22 · 22-37/38-41
- Safety Statements
- 26 · 26-36/39
- WGK Germany
- 3 · 3
- HazardClass
- IRRITANT
- HS Code
- 29333990 · 29333990
- Storage Class
- 11 · 11 - Combustible Solids
- Hazard Classifications
- 4 OralEye · Acute Tox. 4 OralEye Dam. 1Skin Irrit. 2STOT SE 3
Safety & regulation
GHS classification
GHS Classification
Danger
H302 (89.1%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, 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 46 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (89.1%)
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- hs_code
- 29333990
- risk_code
- 22-37/38-41
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07
- hazard_code
- Xn,Xi
- safety_code
- 26-36/39
- hazard_class
- IRRITANT
- Storage Class
- 11 - Combustible Solids
- target organs
- Respiratory system
- Hazard statements
- H302-H315-H318-H335
- Hazard Classifications
- Acute Tox. 4 OralEye Dam. 1Skin Irrit. 2STOT SE 3
- Precautionary statements
- P280-P301+P312+P330-P302+P352-P305+P351+P338+P310
Chemistry & industry
Applications
Uses2-Bromo-5-iodopyridine can be used to develop fluorescent compounds (manisyl-substituted terpyridine, bipyridine, and phenanthroline). It is also a useful reagent for investigating the structure/activity relationships of non-nucleoside adenosine kinase inhibitors.
Upstream & downstream products
Upstream raw materials
Downstream products
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Related reactions
22 records
Compound notes
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