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116833-10-4 | 1,2,4-Thiadiazole-3-acetic acid, 5-amino-α-[(fluoromethoxy)imino]-, (αZ)-
CAS No: 116833-10-4 Catalog No: AG000DAC MDL No:
Product Description
Catalog Number:
AG000DAC
Chemical Name:
1,2,4-Thiadiazole-3-acetic acid, 5-amino-α-[(fluoromethoxy)imino]-, (αZ)-
CAS Number:
116833-10-4
Molecular Formula:
C5H5FN4O3S
Molecular Weight:
220.1816
IUPAC Name:
2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(fluoromethoxyimino)acetic acid
InChI:
InChI=1S/C5H5FN4O3S/c6-1-13-9-2(4(11)12)3-8-5(7)14-10-3/h1H2,(H,11,12)(H2,7,8,10)
InChI Key:
YXCUXZBVADXGBO-UHFFFAOYSA-N
SMILES:
FCO/N=C(/c1nsc(n1)N)\C(=O)O
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.007g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
220.178g/mol
Monoisotopic Mass:
220.007g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
139A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.2
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