CAS 2162-98-3

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Also known as: 2162-98-3, Decane, 1,10-dichloro-, Decamethylene dichloride, 1,10-dichloro-decane, Nsc9484, Decane,10-dichloro-

Molecular Formula

C₁₀H₂₀Cl₂

Molecular Weight

211.17 g/mol

InChI Key

RBBNTRDPSVZESY-UHFFFAOYSA-N

1 2D Structure

CAS 2162-98-3

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

1,10-dichlorodecane

2.1.2 InChI

InChI=1S/C10H20Cl2/c11-9-7-5-3-1-2-4-6-8-10-12/h1-10H2

2.1.3 InChI Key

RBBNTRDPSVZESY-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C(CCCCCCl)CCCCCl

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 2162-98-3

2. Decane, 1,10-dichloro-

3. Decamethylene Dichloride

4. 1,10-dichloro-decane

5. Nsc9484

6. Decane,10-dichloro-

7. 1, 10-dichlorodecane

8. Schembl97813

9. 1,10-dichlorodecane, 99%

10. 1,10-decamethylene Dichloride

11. Dtxsid9062225

12. Amy9370

13. Bcp24948

14. Nsc 9484

15. Nsc-9484

16. Zinc1700010

17. Einecs 218-489-6

18. Mfcd00000957

19. Akos015915528

20. Ds-4660

21. Cs-0100393

22. D0247

23. Ft-0606032

24. D89619

25. Q-200046

26. F8881-4366

2.3 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₁₀H₂₀Cl₂
Molecular Weight	211.17 g/mol
XLogP3	5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	9
Exact Mass	210.0942060 g/mol
Monoisotopic Mass	210.0942060 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