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1269755-05-6 | 6-(IODOMETHYL)-2,2-DIMETHYL-1,4-DIOXANE
CAS No: 1269755-05-6 Catalog No: AG01DSTA MDL No:MFCD26398476
Product Description
Catalog Number:
AG01DSTA
Chemical Name:
6-(IODOMETHYL)-2,2-DIMETHYL-1,4-DIOXANE
CAS Number:
1269755-05-6
Molecular Formula:
C7H13IO2
Molecular Weight:
256.0814
MDL Number:
MFCD26398476
IUPAC Name:
6-(iodomethyl)-2,2-dimethyl-1,4-dioxane
InChI:
InChI=1S/C7H13IO2/c1-7(2)5-9-4-6(3-8)10-7/h6H,3-5H2,1-2H3
InChI Key:
KQSFPOUNRPPJCA-UHFFFAOYSA-N
SMILES:
ICC1COCC(O1)(C)C
Properties
Complexity:
114
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.996g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.083g/mol
Monoisotopic Mass:
255.996g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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