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112031-06-8 | Naphthalene, 1-iodo-2-(methoxymethoxy)-
CAS No: 112031-06-8 Catalog No: AG007CUH MDL No:
Product Description
Catalog Number:
AG007CUH
Chemical Name:
Naphthalene, 1-iodo-2-(methoxymethoxy)-
CAS Number:
112031-06-8
Molecular Formula:
C12H11IO2
Molecular Weight:
314.1190
IUPAC Name:
1-iodo-2-(methoxymethoxy)naphthalene
InChI:
InChI=1S/C12H11IO2/c1-14-8-15-11-7-6-9-4-2-3-5-10(9)12(11)13/h2-7H,8H2,1H3
InChI Key:
LXRMALYLQWJSBB-UHFFFAOYSA-N
SMILES:
COCOc1ccc2c(c1I)cccc2
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.98g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
314.122g/mol
Monoisotopic Mass:
313.98g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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