CAS 16355-92-3

1 2D Structure

2D Structure

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

1,10-diiododecane

2.1.2 InChI

InChI=1S/C10H20I2/c11-9-7-5-3-1-2-4-6-8-10-12/h1-10H2

2.1.3 InChI Key

CKJCTZAIDVFHCX-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C(CCCCCI)CCCCI

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 16355-92-3

2. Decane, 1,10-diiodo-

3. Decamethylene Diiodide

4. Mfcd00001086

5. 1,10-diiododecan

6. Einecs 240-415-6

7. 1,10-diiodo-decane

8. 1,10- Di Iododecane

9. Ec 240-415-6

10. 1,10-diiododecane, 95%

11. Schembl482504

12. Dtxsid5066035

13. Zinc6844955

14. Akos015913438

15. As-57353

16. Cs-0158373

17. D2439

18. Ft-0606034

19. D83366

20. A810485

21. J-010057

22. F0001-0592

2.3 Create Date

2005-03-27

3 Chemical and Physical Properties

Molecular Formula	C₁₀H₂₀I₂
Molecular Weight	394.07 g/mol
XLogP3	6.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	9
Exact Mass	393.96545 g/mol
Monoisotopic Mass	393.96545 g/mol
Topological Polar Surface Area	0 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	64.2
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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