Basic information
- CAS
139022-25-6- Standard SMILES
O=C(O)c1ccc2nccn2c1- InChIKey
ONOJJCTXSDBVSP-UHFFFAOYSA-N- Molecular formula
- C8H6N2O2
- Average molar mass
- 162.15 g/mol
- Monoisotopic mass
- 162.04292744
Names & identifiers
- Preferred name
- Imidazo(1,2-a)pyridine-6-carboxylic acid
- IUPAC
- imidazo[1,2-a]pyridine-6-carboxylic acid
- English name
- imidazo[1,2-a]pyridine-6-carboxylic acid
- Molecular formula
- C8H6N2O2
- Molecular weight
- 162.15
Names & synonyms
Imidazo[1,2-a]pyridine-6-carboxylic acid139022-25-6DTXSID00427738Imidazo(1,2-a)pyridine-6-carboxylic acidRefChem:348582DTXCID80378572640-508-5MFCD07021498SCHEMBL1735281H-IMIDAZO[1,2-A]PYRIDINE-6-CARBOXYLIC ACIDAKOS005071089PB10400
Show more names
EOS-60803Olprinone Impurity 32Imidazo[1,2-a]pyridine-6-...6-Carboxyimidazo[1,2-a]pyridineImidazo[1,2-a]pyridine-6-carboxylicAci6-imidazo[2,1-f]pyridinecarboxylic acidiMidazo[1,2-a]pyridin-6-carboxylic acidimidazo[2,1-f]pyridine-6-carboxylic acidH-iMidazo[1,2-a]pyridin-6-carboxylic acid
4-hydroimidazo[1,2-a]pyridine-6-carboxylic acidImidazo[1,2-a]pyridine-6-carboxylicacidH-imidazo[1,2-a]pyridine-6-carboxylic acidBCP17435ALBB-027668CS-W00554SBB053507CS-W005545
Database identifiers
- CAS
139022-25-6- PubChem CID
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 54.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 195
Physicochemical properties
- Melting point
- 250 · 250
- Density
- 1.41 · 1.41
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- DMSO (Slightly), Methanol (Slightly)
- pka
- 0.67 · 0.67±0.41(Predicted)
- form
- Solid
- color
- Pale Beige to Light Beige
- Stability
- Hygroscopic
- InChI
- InChI=1S/C8H6N2O2/c11-8(12)6-1-2-7-9-3-4-10(7)5-6/h1-5H,(H,11,12)
- InChIKey
- ONOJJCTXSDBVSP-UHFFFAOYSA-N
- SMILES
- C12=NC=CN1C=C(C(O)=O)C=C2
- UNSPSC Code
- 12352106 · 12352106
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Safety & regulation
GHS classification
GHS Classification
Warning
H315 (75%): Causes skin irritation [Warning Skin corrosion/irritation]；H317 (25%): May cause an allergic skin reaction [Warning Sensitization, Skin]；H319 (75%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (75%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P271, P272, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 4 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (75%)；Skin Sens. 1 (25%)；Eye Irrit. 2A (75%)；STOT SE 3 (75%)
Safety data
- hs_code
- 2933599590
- risk_code
- 36/37/38-43
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 22-26-36/37/39-36/37
- hazard_class
- IRRITANT
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Applications
UsesImidazo[1,2-a]pyridine-6-carboxylic acid is a brown solid that should be stored sealed at room temperature and away from light. It is a crucial compound that could be used as a pharmaceutical intermediate in pharmaceutical synthesis and scientific research.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers100 total
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海弘顺生物科技有限公司15901914505 · [email protected]
Related reactions
21 records
Compound notes
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