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125295-22-9 | 1,3,4-Oxadiazole-2-methanamine, 5-methyl-
CAS No: 125295-22-9 Catalog No: AG000NG0 MDL No:MFCD06739049
Product Description
Catalog Number:
AG000NG0
Chemical Name:
1,3,4-Oxadiazole-2-methanamine, 5-methyl-
CAS Number:
125295-22-9
Molecular Formula:
C4H7N3O
Molecular Weight:
113.1179
MDL Number:
MFCD06739049
IUPAC Name:
(5-methyl-1,3,4-oxadiazol-2-yl)methanamine
InChI:
InChI=1S/C4H7N3O/c1-3-6-7-4(2-5)8-3/h2,5H2,1H3
InChI Key:
XCCHRWGNGFXIPS-UHFFFAOYSA-N
SMILES:
Cc1nnc(o1)CN
Properties
Complexity:
77.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
113.059g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
113.12g/mol
Monoisotopic Mass:
113.059g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1
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