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Home > Aldehydes > 2092700-21-3
2092700-21-3 | 1-ethyl-3-(1,3-oxazol-2-yl)-1H-pyrazole-5-carbaldehyde
CAS No: 2092700-21-3 Catalog No: AG01BSQM MDL No:MFCD30538875
Product Description
Catalog Number:
AG01BSQM
Chemical Name:
1-ethyl-3-(1,3-oxazol-2-yl)-1H-pyrazole-5-carbaldehyde
CAS Number:
2092700-21-3
Molecular Formula:
C9H9N3O2
Molecular Weight:
191.1867
MDL Number:
MFCD30538875
IUPAC Name:
2-ethyl-5-(1,3-oxazol-2-yl)pyrazole-3-carbaldehyde
InChI:
InChI=1S/C9H9N3O2/c1-2-12-7(6-13)5-8(11-12)9-10-3-4-14-9/h3-6H,2H2,1H3
InChI Key:
YNDHLUPUSFDFHJ-UHFFFAOYSA-N
SMILES:
O=Cc1cc(nn1CC)c1ncco1
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.069g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.19g/mol
Monoisotopic Mass:
191.069g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
60.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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