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70542-46-0 | 2-ethyl-5-methoxypyrazine
CAS No: 70542-46-0 Catalog No: AG005I4H MDL No:
Product Description
Catalog Number:
AG005I4H
Chemical Name:
2-ethyl-5-methoxypyrazine
CAS Number:
70542-46-0
Molecular Formula:
C7H10N2O
Molecular Weight:
138.1671
IUPAC Name:
ethyl 3-formylbicyclo[2.2.1]hept-5-ene-2-carboxylate
InChI:
InChI=1S/C11H14O3/c1-2-14-11(13)10-8-4-3-7(5-8)9(10)6-12/h3-4,6-10H,2,5H2,1H3
InChI Key:
PTOWCTCRIJFDMK-UHFFFAOYSA-N
SMILES:
CCc1ncc(nc1)OC
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.094g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.23g/mol
Monoisotopic Mass:
194.094g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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