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1023714-94-4 | Naphthalene, 7-iodo-1,2,6-trimethoxy-
CAS No: 1023714-94-4 Catalog No: AG0007A8 MDL No:
Product Description
Catalog Number:
AG0007A8
Chemical Name:
Naphthalene, 7-iodo-1,2,6-trimethoxy-
CAS Number:
1023714-94-4
Molecular Formula:
C13H13IO3
Molecular Weight:
344.1450
IUPAC Name:
7-iodo-1,2,6-trimethoxynaphthalene
InChI:
InChI=1S/C13H13IO3/c1-15-11-5-4-8-6-12(16-2)10(14)7-9(8)13(11)17-3/h4-7H,1-3H3
InChI Key:
VLEIZXXQBXAFBA-UHFFFAOYSA-N
SMILES:
COc1cc2ccc(c(c2cc1I)OC)OC
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
343.991g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
344.148g/mol
Monoisotopic Mass:
343.991g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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