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828295-41-6 | Cyclohexene, 1-iodo-5,6-bis[(2-methoxyethoxy)methoxy]-, (5S,6R)-
CAS No: 828295-41-6 Catalog No: AG004SMK MDL No:
Product Description
Catalog Number:
AG004SMK
Chemical Name:
Cyclohexene, 1-iodo-5,6-bis[(2-methoxyethoxy)methoxy]-, (5S,6R)-
CAS Number:
828295-41-6
Molecular Formula:
C14H25IO6
Molecular Weight:
416.2492
IUPAC Name:
(5S,6R)-1-iodo-5,6-bis(2-methoxyethoxymethoxy)cyclohexene
InChI:
InChI=1S/C14H25IO6/c1-16-6-8-18-10-20-13-5-3-4-12(15)14(13)21-11-19-9-7-17-2/h4,13-14H,3,5-11H2,1-2H3/t13-,14-/m0/s1
InChI Key:
AZFFNXQNELJZRY-KBPBESRZSA-N
SMILES:
COCCOCO[C@@H]1[C@@H](OCOCCOC)CCC=C1I
Properties
Complexity:
287
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
416.07g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
416.252g/mol
Monoisotopic Mass:
416.07g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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