Home Other Building Blocks [5-(2-methylpropyl)-1,3,4-oxadiazol-2-yl]methanamine, oxalic acid

[5-(2-methylpropyl)-1,3,4-oxadiazol-2-yl]methanamine, oxalic acid

CAS No.:
1803561-29-6
Catalog Number:
AG01B9D4
Molecular Formula:
C9H15N3O5
Molecular Weight:
245.2325
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Product Description
Catalog Number:
AG01B9D4
Chemical Name:
[5-(2-methylpropyl)-1,3,4-oxadiazol-2-yl]methanamine, oxalic acid
CAS Number:
1803561-29-6
Molecular Formula:
C9H15N3O5
Molecular Weight:
245.2325
MDL Number:
MFCD28383821
IUPAC Name:
[5-(2-methylpropyl)-1,3,4-oxadiazol-2-yl]methanamine;oxalic acid
InChI:
InChI=1S/C7H13N3O.C2H2O4/c1-5(2)3-6-9-10-7(4-8)11-6;3-1(4)2(5)6/h5H,3-4,8H2,1-2H3;(H,3,4)(H,5,6)
InChI Key:
SZLPVBUTGQRBNM-UHFFFAOYSA-N
SMILES:
OC(=O)C(=O)O.NCc1nnc(o1)CC(C)C
Properties
Complexity:
190  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.101g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
245.235g/mol
Monoisotopic Mass:
245.101g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
140A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties