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2-Ethyloxazolo[4,5-B]pyridine

HCID 10240956
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Basic information

CAS
52333-88-7
Standard SMILES
CCc1nc2ncccc2o1
InChIKey
MJJNKEZINFMDHB-UHFFFAOYSA-N
Molecular formula
C8H8N2O
Average molar mass
148.16 g/mol
Monoisotopic mass
148.06366288

Names & identifiers

Preferred name
2-Ethyloxazolo[4,5-B]pyridine
IUPAC
2-ethyl-[1,3]oxazolo[4,5-b]pyridine
English name
2-ETHYLOXAZOLO[4,5-B]PYRIDINE
Molecular formula
C8H8N2O
Molecular weight
148.16

Names & synonyms

2-ETHYLOXAZOLO[4,5-B]PYRIDINE52333-88-72-ethyl-[1,3]oxazolo[4,5-b]pyridineMFCD111102082-ETHYL[1,3]OXAZOLO[4,5-B]PYRIDINESCHEMBL10272992DTXSID20437112AKOS006307428AB63473AS-8331SY018744DB-314048
Show more names
Oxazolo[4,5-b]pyridine, 2-ethyl-7-Chloro-4H-benzo[1,4]oxazin-3-one2-ETHYLOXAZOLO[4,5-B]PYRIDINE ISO 9001:2015 REACH
CS-0030441Y10989F447817

Database identifiers

CAS
52333-88-7
PubChem CID
10240956
DTXSID
DTXSID20437112
Nikkaji
J513.753E

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
38.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
11
Formal charge
0
Complexity
140

Physicochemical properties

Melting point
51 · 51-53 °C
Boiling point
229 · 229.0±13.0 °C(Predicted)
Density
1.179 · 1.179±0.06 g/cm3(Predicted)
storage temp.
2 · 2-8°C
pka
0.18 · 0.18±0.50(Predicted)
Appearance
Colorless to light yellow Solid
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302
Precautionary statements
280 · P280-P305+P351+P338
HS Code
2933399990 · 2933399990

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

hs_code
2933399990
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302
Precautionary statements
P280-P305+P351+P338

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