5,7-dichloro-1H-imidazo[4,5-b]pyridine
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Basic information
- CAS
24485-01-6- Standard SMILES
Clc1cc(Cl)c2[nH]cnc2n1- InChIKey
IKJFWUNKUZVHGU-UHFFFAOYSA-N- Molecular formula
- C6H3Cl2N3
- Average molar mass
- 188.01 g/mol
- Monoisotopic mass
- 186.97040246
Names & identifiers
- Preferred name
- 5,7-dichloro-1H-imidazo[4,5-b]pyridine
- IUPAC
- 5,7-dichloro-1H-imidazo[4,5-b]pyridine
- English name
- 5,7-Dichloroimidazo[4,5-b]pyridine
- Molecular formula
- C6H3Cl2N3
- Molecular weight
- 188.01
Names & synonyms
5,7-dichloro-1H-imidazo[4,5-b]pyridineDTXSID304214465,7-DICHLORO-1H-IMIDAZO(4,5-B)PYRIDINERefChem:528187DTXCID50372289810-080-624485-01-65,7-DICHLORO-3H-IMIDAZO[4,5-B]PYRIDINE3H-IMIDAZO[4,5-B]PYRIDINE, 5,7-DICHLORO-MFCD111114075,7-Dichloroimidazo[4,5-b]pyridine1H-Imidazo[4,5-b]pyridine, 5,7-dichloro-
Show more names
Nsc2640467-dichloro-1H-iMidazo[4Dichloro-1H-imidazolo [4,5-b] pyridine5,7-dichloro-7aH-imidazo[4,5-b]pyridine(1)5,7-dichloro-3H-imidazo[4,5-b]pyridine5,7-Dichloro-3H-Imidazole (4,5b) Pyridine
SCHEMBL231680857-Dichloro-1H-imidazo[45-b]pyridineIKJFWUSCHEMBL3507178SCHEMBL29539126SCHEMBL29574753IKJFWUNKUZVHGU-UHFFFAOYSA-NFD7016
Database identifiers
- CAS
24485-01-6- PubChem CID
- 5949802
- DTXSID
DTXSID30421446- EC Number
- 810-080-6
- Nikkaji
- J1.160.658J
Properties
Computed structural propertiesFilling in
- XLogP
- 2.3
- Topological polar surface area
- 41.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 155
Physicochemical properties
- Melting point
- 273 · 273-274 °C
- Boiling point
- 200.8 · 200.8±50.0 °C(Predicted)
- Density
- 1.79 · 1.79±0.1 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- pka
- 5.37 · 5.37±0.40(Predicted)
- Appearance
- Off-white to pink Solid
- InChI
- InChI=1S/C6H3Cl2N3/c7-3-1-4(8)11-6-5(3)9-2-10-6/h1-2H,(H,9,10,11)
- InChIKey
- IKJFWUNKUZVHGU-UHFFFAOYSA-N
- SMILES
- C12NC=NC1=C(Cl)C=C(Cl)N=2
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H319-H315
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
- HS Code
- 2933998090 · 2933998090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P280, P301+P317, P302+P352, P305+P351+P338, P321, P330, P332+P317, P337+P317, P362+P364, 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.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2933998090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H319-H315
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Applications
Uses5,7-Dichloro-1H-imidazo[4,5-B]pyridine is an important type of imidazopyridine compound with good antimicrobial and bactericidal effects.
Upstream & downstream products
Upstream raw materials
Related reactions
4 records
Compound notes
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