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23051-85-6 | 2-Imidazolidinone, 4,5-dihydroxy-, (4R,5R)-rel-
CAS No: 23051-85-6 Catalog No: AG002M16 MDL No:
Product Description
Catalog Number:
AG002M16
Chemical Name:
2-Imidazolidinone, 4,5-dihydroxy-, (4R,5R)-rel-
CAS Number:
23051-85-6
Molecular Formula:
C3H6N2O3
Molecular Weight:
118.0913
IUPAC Name:
(4S,5S)-4,5-dihydroxyimidazolidin-2-one
InChI:
InChI=1S/C3H6N2O3/c6-1-2(7)5-3(8)4-1/h1-2,6-7H,(H2,4,5,8)/t1-,2-/m0/s1
InChI Key:
NNTWKXKLHMTGBU-LWMBPPNESA-N
SMILES:
O[C@H]1NC(=O)N[C@@H]1O
Properties
Complexity:
103
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
118.038g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
118.092g/mol
Monoisotopic Mass:
118.038g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
81.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.9
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