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92317-98-1 | 3-(4-iodophenyl)-1,1-dimethyl-urea
CAS No: 92317-98-1 Catalog No: AG0067ZF MDL No:
Product Description
Catalog Number:
AG0067ZF
Chemical Name:
3-(4-iodophenyl)-1,1-dimethyl-urea
CAS Number:
92317-98-1
Molecular Formula:
C9H11IN2O
Molecular Weight:
290.1009
IUPAC Name:
3-(4-iodophenyl)-1,1-dimethylurea
InChI:
InChI=1S/C9H11IN2O/c1-12(2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)
InChI Key:
QXWBCYDYAGDZBL-UHFFFAOYSA-N
SMILES:
CN(C(=O)Nc1ccc(cc1)I)C
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.992g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
290.104g/mol
Monoisotopic Mass:
289.992g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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