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PHENYLTHIOHYDANTOIN-THREONINE

CAS No.:
5789-21-9
Catalog Number:
AG00E9HX
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00E9HX
Chemical Name:
PHENYLTHIOHYDANTOIN-THREONINE
CAS Number:
5789-21-9
MDL Number:
MFCD00038439
IUPAC Name:
5-(1-hydroxyethyl)-3-phenyl-2-sulfanylideneimidazolidin-4-one
InChI:
InChI=1S/C11H12N2O2S/c1-7(14)9-10(15)13(11(16)12-9)8-5-3-2-4-6-8/h2-7,9,14H,1H3,(H,12,16)
InChI Key:
ZPBWLZAKZOHLOP-UHFFFAOYSA-N
EC Number:
227-321-0
NSC Number:
116497
Properties
Complexity:
302  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.062g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
236.289g/mol
Monoisotopic Mass:
236.062g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
84.7A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties