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100558-39-2 | 2,4-Imidazolidinedione, 1-butyl-5-hydroxy-
CAS No: 100558-39-2 Catalog No: AG0002BQ MDL No:MFCD20728631
Product Description
Catalog Number:
AG0002BQ
Chemical Name:
2,4-Imidazolidinedione, 1-butyl-5-hydroxy-
CAS Number:
100558-39-2
Molecular Formula:
C7H12N2O3
Molecular Weight:
172.1818
MDL Number:
MFCD20728631
IUPAC Name:
1-butyl-5-hydroxyimidazolidine-2,4-dione
InChI:
InChI=1S/C7H12N2O3/c1-2-3-4-9-6(11)5(10)8-7(9)12/h6,11H,2-4H2,1H3,(H,8,10,12)
InChI Key:
LWVSHQGAUHQTEW-UHFFFAOYSA-N
SMILES:
CCCCN1C(O)C(=O)NC1=O
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.085g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
172.184g/mol
Monoisotopic Mass:
172.085g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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