trans-2,5-Dimethylpiperazine - ≥98%(GC) , CAS No.2815-34-1

CAS: 2815-34-1 Cat. No.: T138605 Peso molecular: 114.19 Beilstein Registry Number: 23,19 Número EC: 629-352-9

GRADE & PURITY ≥98%(GC)

Synonyms

(2R,5S)-2,5-dimethylpiperazine | (2R,5S)-2,5-DIMETHYL-PIPERAZINE | J-016991 | REL-(2R,5S)-2,5-DIMETHYLPIPERAZINE | 2,5-Dimethylpiperazine (trans) | NSC3708 | NSC-3708 | F12545 | trans-2,5 dimethylpiperazine | 2,5-Dimethylpiperazine, meso- | InChI=1/C6H14N

Storage

Protected from light,Room temperature,Argon charged

Shipped In

Normal

Specifications

Sinónimos

(2R, 5S)-2, 5-dimethylpiperazine | (2R, 5S)-2, 5-DIMETHYL-PIPERAZINE | J-016991 | REL-(2R, 5S)-2, 5-DIMETHYLPIPERAZINE | 2, 5-Dimethylpiperazine (trans) | NSC3708 | NSC-3708 | F12545 | trans-2, 5 dimethylpiperazine | 2, 5-Dimethylpiperazine, meso- | InChI=1/C6H14N

Especificaciones y pureza

≥98%(GC)

Condiciones de almacenamiento de almacenamiento

Protected from light, Room temperature, Argon charged

Enviado en

Normal

Pureza

≥98%(GC)

Nombres e identificadores

• Pubchem Sid: 504757895
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504757895
• Sonrisas canónicas: C[C@H]1CN[C@H](C)CN1
• IUPAC Name: (2R,5S)-2,5-dimethylpiperazine
• InChIKey: NSMWYRLQHIXVAP-OLQVQODUSA-N
• INCHI: 1S/C6H14N2/c1-5-3-8-6(2)4-7-5/h5-8H,3-4H2,1-2H3/t5-,6+
• Isómeros SMILES: C[C@@H]1CN[C@H](CN1)C
• WGK Alemania: 3
• CAS alternativo: 106-55-8
• Número ONU: 2926
• Grupo de embalaje: II
• Peso molecular: 114.19
• Beilstein: 23,19
• Reaxy-Rn: 79886

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Diazinanes
      • Subclass Piperazines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Diazinanes
• Subclass: Piperazines
• Intermediate Tree Nodes: Not available
• Direct Parent: Piperazines
• Alternative Parents: Dialkylamines Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Piperazine - Azacycle - Secondary amine - Secondary aliphatic amine - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Amine - Aliphatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as piperazines. These are compounds containing a piperazine ring, which is a saturated aliphatic six-member heterocyclic with two nitrogen atoms at positions 1 and 4, as well as four carbon atoms.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Propiedades químicas y físicas

• Solubilidad: Soluble in Methanol
• Sensibilidad: Moisture & Air & Light sensitive.
• Punto de inflamación (°F): 100.4 °F
• Punto de inflamación (°C): 38 °C
• Punto de ebullición (°C): 162-165 °C
• Punto de fusión (°C): 115-118 °C
• Peso molecular: 114.190 g/mol
• XLogP3: 0.000
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 114.116 Da
• Monoisotopic Mass: 114.116 Da
• Topological Polar Surface Area: 24.100 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 62.900
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 2
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Referencias

1. Huang Tao, Li Ke, Lei Jinyu, Niu Quan, Peng Hui, Zou Bingsuo.  (2023)  Origin of singlet self-trapped exciton and enhancement of photoluminescence quantum yield of organic–inorganic hybrid antimony(III) chlorides with the [SbCl5]2− units.  Nano Research,      [PMID:] [10.1007/s12274-023-6029-8]

2. Tao Huang, Qilin Wei, Tongzhou Li, Hui Peng, Bingsuo Zou.  (2023)  Efficient Yellow Emission and Near-Unified Photoluminescence Quantum Yield of Sb3+ in a One-Dimensional Confinement Cadmium Chloride Lattice.  ACS Applied Electronic Materials,      [PMID:] [10.1021/acsaelm.3c00183]

3. Tao Huang, Qilin Wei, Wenchao Lin, Hui Peng, Shangfei Yao, Bingsuo Zou.  (2022)  High-efficient yellow-green emission in (TDMP)MnBr4 single crystal with modulation of spin-phonon-charge interactions.  Materials Today Physics,      [PMID:] [10.1016/j.mtphys.2022.100703]

4. Tao Huang, Hui Peng, Qilin Wei, Chengyu Peng, Ye Tian, Shangfei Yao, Xinxin Han, Bingsuo Zou.  (2021)  Magnetic polaronic and bipolaronic excitons in Mn(II) doped (TDMP)PbBr4 and their high emission.  Nano Energy,      [PMID:] [10.1016/j.nanoen.2021.106863]

5. Ruijing Fu, Junpeng Gao, Lingrui Wang, Bin Xiao, Tao Hu, Guangxia Wang, Qingguang Zeng, Guanjun Xiao.  (2024)  Structure Evolution and Optical Tuning of One-Dimensional Post-perovskite (TDMP)PbBr4 under High Pressure.  INORGANIC CHEMISTRY,      [PMID:39295474] [10.1021/acs.inorgchem.4c03145]

6. Chuxiong Zhou, Yujun Zhou, Ou Xu, Linghang Kong, Wei Tian, Xuda Kan, Tao Huang, Bingsuo Zou.  (2025)  Record-High Photoluminescence Efficiency and Excellent Scintillation in Two-Dimensional Diamine Hybrid Copper(I) Halides.  ACS Applied Materials & Interfaces,      [PMID:40928952] [10.1021/acsami.5c12482]