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13148-65-7 | 1,3,4-Oxadiazole, 2,5-dimethyl-
CAS No: 13148-65-7 Catalog No: AG000WA1 MDL No:MFCD00483011
Product Description
Catalog Number:
AG000WA1
Chemical Name:
1,3,4-Oxadiazole, 2,5-dimethyl-
CAS Number:
13148-65-7
Molecular Formula:
C4H6N2O
Molecular Weight:
98.1032
MDL Number:
MFCD00483011
IUPAC Name:
2,5-dimethyl-1,3,4-oxadiazole
InChI:
InChI=1S/C4H6N2O/c1-3-5-6-4(2)7-3/h1-2H3
InChI Key:
YVDWFZIVIIKYBQ-UHFFFAOYSA-N
SMILES:
Cc1nnc(o1)C
Properties
Complexity:
58.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
98.048g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
98.105g/mol
Monoisotopic Mass:
98.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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