CAS 38922-77-9 Ethyl imidazo[1,2-a]pyridine-2-carboxylate (HCID 818807)

Substructure search Find similar structures

Basic information

CAS: 38922-77-9
Standard SMILES: CCOC(=O)c1cn2ccccc2n1
InChIKey: GNFACXDTRBVZJE-UHFFFAOYSA-N
Molecular formula: C10H10N2O2
Average molar mass: 190.2 g/mol
Monoisotopic mass: 190.07422756

Names & identifiers

Preferred name: Ethyl imidazo[1,2-a]pyridine-2-carboxylate
IUPAC: ethyl imidazo[1,2-a]pyridine-2-carboxylate
English name: Imidazo[1,2-a]pyridine-2-carboxylic acid ethyl ester
Molecular formula: C10H10N2O2
Molecular weight: 190.2

Names & synonyms

ethyl imidazo[1,2-a]pyridine-2-carboxylate38922-77-9DTXSID40355980ethyl imidazo(1,2-a)pyridine-2-carboxylateRefChem:344862DTXCID30307039968-225-5Imidazo[1,2-a]pyridine-2-carboxylic acid ethyl esterMFCD02325394SCHEMBL101682EthylImidazo[1,2-a]pyridine-2-carboxylateSTL412485

Show more names

2-(Ethoxycarbonyl)imidazo[1,2-a]pyridineethyl 3-imidazo[1,2-a]pyridine-2-carboxylateEthyl imidazo[1,2-a]pyridine-2-carboxylate 97%Ethyl imidazo[1,2-a]pyridine-2-carboxylate ,97%Imidazo-[1,2-A] pyridine-2-carboxylate ethyl ester

lmidazo[1,2-a]pyridine-2-carboxylic acid ethyl esterAC-24321SY004050EN300-03957ethyl imidazolo[1,2-a]pyridine-2-carboxylateAI-204/31692003ethyl 4-hydroimidazo[1,2-a]pyridine-2-carboxylateimidazo[1,2-a]pyridine-2-carboxylic acid, ethyl ester

Database identifiers

CAS: 38922-77-9
PubChem CID: 818807
DTXSID

Properties

Computed structural properties

XLogP: 2.3
Topological polar surface area: 43.6 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 14
Formal charge: 0
Complexity: 220

Physicochemical properties

Melting point: 79.5 · 79.5-83
Density: 1.22 · 1.22±0.1 g/cm3(Predicted)
storage temp.: Sealed in dry,Room Temperature
form: solid
pka: 3.28 · 3.28±0.50(Predicted)
Appearance: Off-white to light brown Solid
InChI: InChI=1S/C10H10N2O2/c1-2-14-10(13)8-7-12-6-4-3-5-9(12)11-8/h3-7H,2H2,1H3
InChIKey: GNFACXDTRBVZJE-UHFFFAOYSA-N
SMILES: C12=NC(C(OCC)=O)=CN1C=CC=C2
CAS DataBase Reference: 38922 · 38922-77-9(CAS DataBase Reference)
UNSPSC Code: 12352100 · 12352100
NACRES: 22 · NA.22
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+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.