Close
4

Overview

Client Email Product
CAS 1129634-44-1
PharmaCompass
CAS 1129634-44-1
Also known as: 1129634-44-1, (s)-5-(tert-butoxycarbonyl)-5-azaspiro[2.4]heptane-6-carboxylic acid, (6s)-5-[(tert-butoxy)carbonyl]-5-azaspiro[2.4]heptane-6-carboxylic acid, (6s)-5-(tert-butoxycarbonyl)-5-azaspiro[2.4]heptane-6-carboxylic acid, Ak-90267, En300-39139
Molecular Formula
C12H19NO4
Molecular Weight
241.287  g/mol
InChI Key
VEIYKHIPSJIVRK-QMMMGPOBSA-N

1 2D Structure

CAS 1129634-44-1

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(6S)-5-[(2-methylpropan-2-yl)oxycarbonyl]-5-azaspiro[2.4]heptane-6-carboxylic acid
2.1.2 InChI
InChI=1S/C12H19NO4/c1-11(2,3)17-10(16)13-7-12(4-5-12)6-8(13)9(14)15/h8H,4-7H2,1-3H3,(H,14,15)/t8-/m0/s1
2.1.3 InChI Key
VEIYKHIPSJIVRK-QMMMGPOBSA-N
2.1.4 Canonical SMILES
CC(C)(C)OC(=O)N1CC2(CC2)CC1C(=O)O
2.1.5 Isomeric SMILES
CC(C)(C)OC(=O)N1CC2(CC2)C[C@H]1C(=O)O
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 1129634-44-1

2. (s)-5-(tert-butoxycarbonyl)-5-azaspiro[2.4]heptane-6-carboxylic Acid

3. (6s)-5-[(tert-butoxy)carbonyl]-5-azaspiro[2.4]heptane-6-carboxylic Acid

4. (6s)-5-(tert-butoxycarbonyl)-5-azaspiro[2.4]heptane-6-carboxylic Acid

5. Ak-90267

6. En300-39139

7. 5-azaspiro[2.4]heptane-5,6-dicarboxylic Acid, 5-(1,1-dimethylethyl) Ester, (6s)-

8. (s)-5-(tert-butoxycarbonyl)-5-azaspiro(2.4)heptane-6-carboxylic Acid

9. Schembl193274

10. (6r)-5-[(tert-butoxy)carbonyl]-5-azaspiro[2.4]heptane-6-carboxylic Acid

11. Ctk7g2645

12. Dtxsid40653857

13. Molport-005-313-767

14. Molport-044-812-989

15. Veiykhipsjivrk-qmmmgpobsa-n

16. Cs-m2570

17. 2887ah

18. Mfcd11099673

19. Mfcd21363350

20. Zinc32628536

21. Akos010366500

22. Acn-043293

23. Cm14171

24. Cm14188

25. Fch3444576

26. Ac-28381

27. Aj-85444

28. Ds-16827

29. Ax8222109

30. Ks-00000608

31. (5s)-6-tert-butoxycarbonyl-6-azaspiro[2.4]heptane-5-carboxylic Acid

32. (s)-5 -(tert-butoxycarbonyl)-5-azaspiro[2.4]heptane-6-carboxylic Acid

33. 6-azaspiro[2.4]heptane-5beta,6-dicarboxylic Acid 6-tert-butyl Ester

34. (6s)-5-[(2-methylpropan-2-yl)oxycarbonyl]-5-azaspiro[2.4]heptane-6-carboxylic Acid

35. Potassium (6s)-5-[(tert-butoxy)carbonyl]-5-azaspiro[2.4]heptane-6-carboxylic Acid

2.3 Create Date
2009-05-29
3 Chemical and Physical Properties
Molecular Weight 241.287 g/mol
Molecular Formula C12H19NO4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass241.131 g/mol
Monoisotopic Mass241.131 g/mol
Topological Polar Surface Area66.8 A^2
Heavy Atom Count17
Formal Charge0
Complexity354
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
Ask Us for Pharmaceutical Supplier and Partner
Ask Us, Find A Supplier / Partner
No Commissions, No Strings Attached, Get Connected for FREE

What are you looking for?

How can we help you?

The request can't be empty

Please read our Privacy Policy carefully

You must agree to the privacy policy

The name can't be empty
The company can't be empty.
The email can't be empty Please enter a valid email.
The mobile can't be empty

Advertise With Us

Advertise With Us