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898767-90-3 | 8-(4-IODOPHENYL)-8-OXOOCTANENITRILE
CAS No: 898767-90-3 Catalog No: AG00GW7A MDL No:
Product Description
Catalog Number:
AG00GW7A
Chemical Name:
8-(4-IODOPHENYL)-8-OXOOCTANENITRILE
CAS Number:
898767-90-3
IUPAC Name:
8-(4-iodophenyl)-8-oxooctanenitrile
InChI:
InChI=1S/C14H16INO/c15-13-9-7-12(8-10-13)14(17)6-4-2-1-3-5-11-16/h7-10H,1-6H2
InChI Key:
BWBAVCUYDQLOGZ-UHFFFAOYSA-N
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
341.028g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
341.192g/mol
Monoisotopic Mass:
341.028g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
40.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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