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137654-41-2 | 1,2,4-Oxadiazole-5-acetic acid, 3-(fluoroamino)-, ethyl ester
CAS No: 137654-41-2 Catalog No: AG0013OE MDL No:
Product Description
Catalog Number:
AG0013OE
Chemical Name:
1,2,4-Oxadiazole-5-acetic acid, 3-(fluoroamino)-, ethyl ester
CAS Number:
137654-41-2
Molecular Formula:
C6H8FN3O3
Molecular Weight:
189.1444
IUPAC Name:
ethyl 2-[3-(fluoroamino)-1,2,4-oxadiazol-5-yl]acetate
InChI:
InChI=1S/C6H8FN3O3/c1-2-12-5(11)3-4-8-6(9-7)10-13-4/h2-3H2,1H3,(H,9,10)
InChI Key:
BYJAAUAFNOVZKN-UHFFFAOYSA-N
SMILES:
CCOC(=O)Cc1nc(no1)NF
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.055g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
189.146g/mol
Monoisotopic Mass:
189.055g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
77.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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