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81136-86-9 | Pyrazine, 2,5-dihydro-3,6-dimethoxy-2-methyl-5-(1-methylethyl)-
CAS No: 81136-86-9 Catalog No: AG005GDG MDL No:
Product Description
Catalog Number:
AG005GDG
Chemical Name:
Pyrazine, 2,5-dihydro-3,6-dimethoxy-2-methyl-5-(1-methylethyl)-
CAS Number:
81136-86-9
Molecular Formula:
C10H18N2O2
Molecular Weight:
198.2621
IUPAC Name:
3,6-dimethoxy-2-methyl-5-propan-2-yl-2,5-dihydropyrazine
InChI:
InChI=1S/C10H18N2O2/c1-6(2)8-10(14-5)11-7(3)9(12-8)13-4/h6-8H,1-5H3
InChI Key:
AGSVBAIKOLJRNR-UHFFFAOYSA-N
SMILES:
COC1=NC(C(C)C)C(=NC1C)OC
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.137g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.266g/mol
Monoisotopic Mass:
198.137g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
43.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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