6-Ethoxyimidazo[1,2-b]pyridazine

HCID 20076618
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Basic information

CAS
57470-53-8
Standard SMILES
CCOc1ccc2nccn2n1
InChIKey
MXFQECQTZILHAC-UHFFFAOYSA-N
Molecular formula
C8H9N3O
Average molar mass
163.18 g/mol
Monoisotopic mass
163.07456192

Names & identifiers

Preferred name
6-Ethoxyimidazo[1,2-b]pyridazine
IUPAC
6-ethoxyimidazo[1,2-b]pyridazine
English name
6-Ethoxyimidazo[1,2-b]pyridazine
Molecular formula
C8H9N3O
Molecular weight
163.17656

Names & synonyms

6-ethoxyimidazo[1,2-b]pyridazine57470-53-8MFCD18782899SCHEMBL9120634DTXSID20602181MXFQECQTZILHAC-UHFFFAOYSA-NAKOS015950286SY318929Imidazo[1,2-b]pyridazine, 6-ethoxy-

Database identifiers

CAS
57470-53-8
PubChem CID
20076618
DTXSID
DTXSID20602181

Properties

Computed structural properties

XLogP
1
Topological polar surface area
39.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
12

Physicochemical properties

Density
1.25 · 1.25±0.1 g/cm3(Predicted)
pka
4.86 · 4.86±0.30(Predicted)
form
solid
InChI
1S/C8H9N3O/c1-2-12-8-4-3-7-9-5-6-11(7)10-8/h3-6H,2H2,1H3
InChIKey
MXFQECQTZILHAC-UHFFFAOYSA-N
SMILES
CCOC(C=C1)=NN2C1=NC=C2

Safety & regulation

Safety data

wgk
WGK 3
hs_code
2933998090
risk_code
43
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi

Chemistry & industry

Suppliers2 total

斯派螺（武汉）药物研发有限公司[email protected]
上海辰烛医药科技有限公司13162380607 · [email protected]

Related reactions

4 records
New reaction record

Compound notes

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