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Home > Imidazoles > 1343118-62-6
1343118-62-6 | 2-METHYL-5-[(2-METHYL-1H-IMIDAZOL-1-YL)METHYL]-1,3,4-OXADIAZOLE
CAS No: 1343118-62-6 Catalog No: AG01BTAQ MDL No:MFCD18840484
Product Description
Catalog Number:
AG01BTAQ
Chemical Name:
2-METHYL-5-[(2-METHYL-1H-IMIDAZOL-1-YL)METHYL]-1,3,4-OXADIAZOLE
CAS Number:
1343118-62-6
Molecular Formula:
C8H10N4O
Molecular Weight:
178.1912
MDL Number:
MFCD18840484
IUPAC Name:
2-methyl-5-[(2-methylimidazol-1-yl)methyl]-1,3,4-oxadiazole
InChI:
InChI=1S/C8H10N4O/c1-6-9-3-4-12(6)5-8-11-10-7(2)13-8/h3-4H,5H2,1-2H3
InChI Key:
WNNNLTPFDPODHY-UHFFFAOYSA-N
SMILES:
Cc1nnc(o1)Cn1ccnc1C
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.085g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.195g/mol
Monoisotopic Mass:
178.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
56.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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