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56634-96-9 | 4-cyano-2,6-diiodophenyl heptanoate
CAS No: 56634-96-9 Catalog No: AG00ERJW MDL No:
Product Description
Catalog Number:
AG00ERJW
Chemical Name:
4-cyano-2,6-diiodophenyl heptanoate
CAS Number:
56634-96-9
IUPAC Name:
(4-cyano-2,6-diiodophenyl) heptanoate
InChI:
InChI=1S/C14H15I2NO2/c1-2-3-4-5-6-13(18)19-14-11(15)7-10(9-17)8-12(14)16/h7-8H,2-6H2,1H3
InChI Key:
GIOFUTQKURPXPS-UHFFFAOYSA-N
EC Number:
260-302-5
Properties
Complexity:
328
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
482.919g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
483.088g/mol
Monoisotopic Mass:
482.919g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
50.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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