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918334-75-5 | 2-Butenamide, N-(2-iodophenyl)-N-methyl-, (2E)-
CAS No: 918334-75-5 Catalog No: AG006GAU MDL No:
Product Description
Catalog Number:
AG006GAU
Chemical Name:
2-Butenamide, N-(2-iodophenyl)-N-methyl-, (2E)-
CAS Number:
918334-75-5
Molecular Formula:
C11H12INO
Molecular Weight:
301.1235
IUPAC Name:
N-(2-iodophenyl)-N-methylbut-2-enamide
InChI:
InChI=1S/C11H12INO/c1-3-6-11(14)13(2)10-8-5-4-7-9(10)12/h3-8H,1-2H3
InChI Key:
OEALSYUUNPNVOU-UHFFFAOYSA-N
SMILES:
C/C=C/C(=O)N(c1ccccc1I)C
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.996g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
301.127g/mol
Monoisotopic Mass:
300.996g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.8
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