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(±)-trans-1-Allyl-2,5-dimethylpiperazine - 97%, high purity , CAS No.155766-33-9
Discover (±)-trans-1-Allyl-2,5-dimethylpiperazine by Aladdin Scientific in 97% for only $151.90. Available - in Ligands at Aladdin Scientific. Tags: .
Basic Description
Synonyms
MFCD09753425 | (+/-)-trans-1-Allyl-2,5-dimethylpiperazine, 97% | SCHEMBL231228 | (2R,5S)-2,5-DIMETHYL-1-(PROP-2-EN-1-YL)PIPERAZINE | (2R,5S)-1-Allyl-2,5-dimethylpiperazine | DTXSID401235781 | (2R,5S)-2,5-dimethyl-1-prop-2-enylpiperazine | (2R, 5S)-1-allyl
Specifications & Purity
≥97%
Storage Temp
Room temperature
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazinanes
Subclass
Piperazines
Intermediate Tree Nodes
Not available
Direct Parent
N-alkylpiperazines
Alternative Parents
Trialkylamines Dialkylamines Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
N-alkylpiperazine - Tertiary aliphatic amine - Tertiary amine - Azacycle - Secondary amine - Secondary aliphatic amine - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Amine - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-alkylpiperazines. These are organic compounds containing a piperazine ring where the nitrogen ring atom carries an alkyl group.
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.
Names and Identifiers
IUPAC Name
(2R,5S)-2,5-dimethyl-1-prop-2-enylpiperazine
INCHI
InChI=1S/C9H18N2/c1-4-5-11-7-8(2)10-6-9(11)3/h4,8-10H,1,5-7H2,2-3H3/t8-,9+/m0/s1
InChIKey
VKUXNUOPPQWDMV-DTWKUNHWSA-N
Smiles
CC1CNC(CN1CC=C)C
Isomeric SMILES
C[C@@H]1CN[C@H](CN1CC=C)C
WGK Germany
3
PubChem CID
10534891
Molecular Weight
154.25
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Flash Point(°F)
136.4 °F
Flash Point(°C)
58 °C
Molecular Weight
154.250 g/mol
XLogP3
1.100
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
2
Exact Mass
154.147 Da
Monoisotopic Mass
154.147 Da
Topological Polar Surface Area
15.300 Ų
Heavy Atom Count
11
Formal Charge
0
Complexity
134.000
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
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