Cyclo(D-Ala-Val)
Need Assistance?
  • US & Canada:
    +
  • UK: +

Cyclo(D-Ala-Val)

* Please kindly note that our products are not to be used for therapeutic purposes and cannot be sold to patients.

Category
Others
Catalog number
BAT-014423
CAS number
15136-27-3
Molecular Formula
C8H14N2O2
Molecular Weight
170.21
IUPAC Name
(3R,6S)-3-methyl-6-propan-2-ylpiperazine-2,5-dione
Synonyms
2,5-Piperazinedione, 3-methyl-6-(1-methylethyl)-, (3R,6S)-; (3S,6R)-3-Isopropyl-6-methyl-2,5-piperazinedione; Cyclo(-D-Ala-Val)
Related CAS
22160-42-5 (rac-isomer) 55904-06-8 ((3R,6R)-isomer) 55904-05-7 ((3S,6R)-isomer) 15136-26-2 ((3S,6S)-isomer)
Appearance
White Crystal
Purity
≥95%
Density
1.040±0.06 g/cm3 (Predicted)
Melting Point
272-275°C
Boiling Point
429.7±38.0°C (Predicted)
Storage
Store at -20°C
Solubility
Soluble in Water
InChI
InChI=1S/C8H14N2O2/c1-4(2)6-8(12)9-5(3)7(11)10-6/h4-6H,1-3H3,(H,9,12)(H,10,11)/t5-,6+/m1/s1
InChI Key
ORLDMMKUTCCBSM-RITPCOANSA-N
Canonical SMILES
CC1C(=O)NC(C(=O)N1)C(C)C
1. Spiro-[cyclo-pentane-1,2'(1'H)-pyrido[2,3-d]pyrimidin]-4'(3'H)-one
Daxin Shi, Liupan Yang, Jianhong Tang, Xiuzhen Wang, Jiarong Li Acta Crystallogr Sect E Struct Rep Online. 2010 Aug 18;66(Pt 9):o2301. doi: 10.1107/S1600536810027479.
The title compound, C(11)H(13)N(2)O, was obtained by cyclo-condensation of 2-amino-pyridine-3-carbonitrile with cyclo-penta-none. The mol-ecule is built up from two fused six-membered rings and one five-membered ring linked through a spiro C atom. Both the pyrimidine and the cyclo-pentane rings adopt envelope conformations. In the crystal structure, mol-ecules are linked by inter-molecular N-H⋯O hydrogen bonds.
Online Inquiry
Verification code
Inquiry Basket