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898731-72-1 | 3,5-Diiodo-2-methoxy-benzonitrile
CAS No: 898731-72-1 Catalog No: AG00IFV1 MDL No:
Product Description
Catalog Number:
AG00IFV1
Chemical Name:
3,5-Diiodo-2-methoxy-benzonitrile
CAS Number:
898731-72-1
IUPAC Name:
3,5-diiodo-2-methoxybenzonitrile
InChI:
InChI=1S/C8H5I2NO/c1-12-8-5(4-11)2-6(9)3-7(8)10/h2-3H,1H3
InChI Key:
CIUAETIYCHXSBK-UHFFFAOYSA-N
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
384.846g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
384.943g/mol
Monoisotopic Mass:
384.846g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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