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64179-17-5 | 2-IODOMETHYL-1,4-DIOXANE
CAS No: 64179-17-5 Catalog No: AG00EG4G MDL No:MFCD06410731
Product Description
Catalog Number:
AG00EG4G
Chemical Name:
2-IODOMETHYL-1,4-DIOXANE
CAS Number:
64179-17-5
Molecular Formula:
C5H9IO2
Molecular Weight:
228.0282
MDL Number:
MFCD06410731
IUPAC Name:
2-(iodomethyl)-1,4-dioxane
InChI:
InChI=1S/C5H9IO2/c6-3-5-4-7-1-2-8-5/h5H,1-4H2
InChI Key:
WWQGIZUTLRNTBG-UHFFFAOYSA-N
SMILES:
ICC1COCCO1
Properties
Complexity:
67.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.965g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.029g/mol
Monoisotopic Mass:
227.965g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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