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6630-51-9 | 4-[2-(4-chlorophenyl)ethyl]-2,5-dioxoimidazolidine-4-carbaldehyde
CAS No: 6630-51-9 Catalog No: AG006NJR MDL No:
Product Description
Catalog Number:
AG006NJR
Chemical Name:
4-[2-(4-chlorophenyl)ethyl]-2,5-dioxoimidazolidine-4-carbaldehyde
CAS Number:
6630-51-9
Molecular Formula:
C12H11ClN2O3
Molecular Weight:
266.6803
IUPAC Name:
4-[2-(4-chlorophenyl)ethyl]-2,5-dioxoimidazolidine-4-carbaldehyde
InChI:
InChI=1S/C12H11ClN2O3/c13-9-3-1-8(2-4-9)5-6-12(7-16)10(17)14-11(18)15-12/h1-4,7H,5-6H2,(H2,14,15,17,18)
InChI Key:
URRAORPLKZZYEP-UHFFFAOYSA-N
SMILES:
O=CC1(CCc2ccc(cc2)Cl)NC(=O)NC1=O
NSC Number:
60875
Properties
Complexity:
366
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.046g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
266.681g/mol
Monoisotopic Mass:
266.046g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
75.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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