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86479-05-2 | 1-Propanone, 2-iodo-1-(6-methoxy-2-naphthalenyl)-
CAS No: 86479-05-2 Catalog No: AG004WHB MDL No:
Product Description
Catalog Number:
AG004WHB
Chemical Name:
1-Propanone, 2-iodo-1-(6-methoxy-2-naphthalenyl)-
CAS Number:
86479-05-2
Molecular Formula:
C14H13IO2
Molecular Weight:
340.1563
IUPAC Name:
2-iodo-1-(6-methoxynaphthalen-2-yl)propan-1-one
InChI:
InChI=1S/C14H13IO2/c1-9(15)14(16)12-4-3-11-8-13(17-2)6-5-10(11)7-12/h3-9H,1-2H3
InChI Key:
SWPCNFVZYHOPIM-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)ccc(c2)C(=O)C(I)C
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.996g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
340.16g/mol
Monoisotopic Mass:
339.996g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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