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790207-00-0 | Ethyl 5-(2-aminoethyl);-1,2,4-oxadiazole-3-carboxylate
CAS No: 790207-00-0 Catalog No: AG0054HC MDL No:MFCD11227254
Product Description
Catalog Number:
AG0054HC
Chemical Name:
Ethyl 5-(2-aminoethyl);-1,2,4-oxadiazole-3-carboxylate
CAS Number:
790207-00-0
Molecular Formula:
C7H11N3O3
Molecular Weight:
185.1805
MDL Number:
MFCD11227254
IUPAC Name:
ethyl 5-(2-aminoethyl)-1,2,4-oxadiazole-3-carboxylate
InChI:
InChI=1S/C7H11N3O3/c1-2-12-7(11)6-9-5(3-4-8)13-10-6/h2-4,8H2,1H3
InChI Key:
PFCATDAIDKUEFO-UHFFFAOYSA-N
SMILES:
NCCc1onc(n1)C(=O)OCC
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.08g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
185.183g/mol
Monoisotopic Mass:
185.08g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
91.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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