Ethyl 5-bromopyrazolo[1,5-a]pyridine-3-carboxylate

HCID 53249841CAS 885276-93-7

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Basic information

Standard SMILES: CCOC(=O)c1cnn2ccc(Br)cc12
InChIKey: LJKZKCQPVABNLG-UHFFFAOYSA-N
Molecular formula: C10H9BrN2O2
Average molar mass: 269.09 g/mol
Monoisotopic mass: 267.98473963

Names & identifiers

Preferred name: Ethyl 5-bromopyrazolo[1,5-a]pyridine-3-carboxylate
IUPAC: ethyl 5-bromopyrazolo[1,5-a]pyridine-3-carboxylate
English name: 5-Bromo-pyrazolo[1,5-a]pyridine-3-carboxylic acid ethyl ester
Molecular formula: C10H9BrN2O2
Molecular weight: 269.09

Names & synonyms

ETHYL 5-BROMOPYRAZOLO[1,5-A]PYRIDINE-3-CARBOXYLATEDTXSID90693081Ethyl 5-bromopyrazolo(1,5-a)pyridine-3-carboxylateRefChem:595729DTXCID00643830892-168-4885276-93-75-BROMO-PYRAZOLO[1,5-A]PYRIDINE-3-CARBOXYLIC ACID ETHYL ESTERMFCD06739182SCHEMBL3074755Ethyl5-bromopyrazolo[1,5-a]pyridine-3-carboxylateAMY23626

Show more names

Ethyl 5-broMopyrazolo[1,5...Ethyl 5-bromopyrazolo1,5-apyridin-3-carboxylateethyl 5-broMoH-pyrazolo[1,5-a]pyridine-3-carboxylate5-Bromo-pyrazolo[1,5-a]pyridine-3-carboxylate ethyl ester5-Bromopyrazolo[1,5-a]pyridin-3-carboxylic acid ethyl ester5-bromo-3-pyrazolo[1,5-a]pyridinecarboxylic acid ethyl ester5-BroMo-1H-pyrazolo[1,5-a]pyridin-3-carboxylic acid ethyl esterPyrazolo[1,5-a]pyridine-3-carboxylicacid, 5-bromo-, ethyl es...Pyrazolo[1,5-a]pyridine-3-carboxylic acid, 5-broMo-, ethyl ester

CS-B1060Pyrazolo[1,5-a]pyridine-3-carboxylicacid, 5-bromo-, ethyl esterAKOS015998966PB21960DS-18508SY097009DB-077693EN300-234964

Database identifiers

CAS: 885276-93-7
PubChem CID: 53249841
DTXSID: DTXSID90693081
EC Number: 892-168-4

Properties

Computed structural properties

XLogP: 2
Topological polar surface area: 43.6 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 15
Formal charge: 0
Complexity: 250

Physicochemical properties

Density: 1.6 · 1.60±0.1 g/cm3(Predicted)
storage temp.: Sealed in dry,Room Temperature
pka: -0.16 · -0.16±0.30(Predicted)
Appearance: White to off-white Solid
InChI: InChI=1S/C10H9BrN2O2/c1-2-15-10(14)8-6-12-13-4-3-7(11)5-9(8)13/h3-6H,2H2,1H3
InChIKey: LJKZKCQPVABNLG-UHFFFAOYSA-N
SMILES: C12=C(C(OCC)=O)C=NN1C=CC(Br)=C2
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P301+P312-P302+P352-P304+P340-P305+P351+P338

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): 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)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.