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920985-83-7 | 5,6-Heptadienamide, N-(2-iodophenyl)-
CAS No: 920985-83-7 Catalog No: AG0066XQ MDL No:
Product Description
Catalog Number:
AG0066XQ
Chemical Name:
5,6-Heptadienamide, N-(2-iodophenyl)-
CAS Number:
920985-83-7
Molecular Formula:
C13H14INO
Molecular Weight:
327.1608
IUPAC Name:
N-(2-iodophenyl)hepta-5,6-dienamide
InChI:
InChI=1S/C13H14INO/c1-2-3-4-5-10-13(16)15-12-9-7-6-8-11(12)14/h3,6-9H,1,4-5,10H2,(H,15,16)
InChI Key:
SZASZGQMBSMSQC-UHFFFAOYSA-N
SMILES:
C=C=CCCCC(=O)Nc1ccccc1I
Properties
Complexity:
271
Compound Is Canonicalized:
No
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.012g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
327.165g/mol
Monoisotopic Mass:
327.012g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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