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51307-42-7 | [(Acetyloxy)carbamothioyl]amino acetate
CAS No: 51307-42-7 Catalog No: AG01FCH0 MDL No:
Product Description
Catalog Number:
AG01FCH0
Chemical Name:
[(Acetyloxy)carbamothioyl]amino acetate
CAS Number:
51307-42-7
Molecular Formula:
C5H8N2O4S
Molecular Weight:
192.1930
IUPAC Name:
(acetyloxycarbamothioylamino) acetate
InChI:
InChI=1S/C5H8N2O4S/c1-3(8)10-6-5(12)7-11-4(2)9/h1-2H3,(H2,6,7,12)
InChI Key:
OIRITLQPIWZORZ-UHFFFAOYSA-N
SMILES:
S=C(NOC(=O)C)NOC(=O)C
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.02g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
192.189g/mol
Monoisotopic Mass:
192.02g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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