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Also known as: 144230-50-2, 4-methylenepiperidine hcl, 4-methylidenepiperidine hydrochloride, 4-methylenepiperidinehydrochloride, 4-methylidenepiperidine;hydrochloride, 4-methylene piperidine hydrochloride
Molecular Formula
C6H12ClN
Molecular Weight
133.62  g/mol
InChI Key
XGMSENVPQPNOHF-UHFFFAOYSA-N

CAS 144230-50-2
1 2D Structure

CAS 144230-50-2

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
4-methylidenepiperidine;hydrochloride
2.1.2 InChI
InChI=1S/C6H11N.ClH/c1-6-2-4-7-5-3-6;/h7H,1-5H2;1H
2.1.3 InChI Key
XGMSENVPQPNOHF-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C=C1CCNCC1.Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 144230-50-2

2. 4-methylenepiperidine Hcl

3. 4-methylidenepiperidine Hydrochloride

4. 4-methylenepiperidinehydrochloride

5. 4-methylidenepiperidine;hydrochloride

6. 4-methylene Piperidine Hydrochloride

7. 4-methylidenepiperidine,hydrochloride

8. Mfcd17977038

9. Schembl1338990

10. Amy6167

11. Dtxsid20627435

12. 4-methylene-piperidine Hydrochloride

13. Bcp15107

14. Cs-d0508

15. Akos015844463

16. Sb14627

17. As-43132

18. Sy022740

19. Db-113397

20. Ft-0701089

21. En300-70265

22. Piperidine, 4-methylene-, Hydrochloride (1:1)

23. 4-methylidenepiperidine--hydrogen Chloride (1/1)

24. A854597

25. F8888-3171

26. Z1895582832

2.3 Create Date
2007-12-05
3 Chemical and Physical Properties
Molecular Weight 133.62 g/mol
Molecular Formula C6H12ClN
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass133.0658271 g/mol
Monoisotopic Mass133.0658271 g/mol
Topological Polar Surface Area12 Ų
Heavy Atom Count8
Formal Charge0
Complexity68.2
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2

BUILDING BLOCK

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