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Hexadimethrine bromide - 90%, high purity , CAS No.28728-55-4
Basic Description
Synonyms
AKOS040740806 | LS-14259 | 4C905MSK4W | 6,3-Ionene bromide | NCGC00090921-01 | CHEBI:5699 | NSC 25133 | 1,3-dibromopropane;N,N,N',N'-tetramethylhexane-1,6-diamine | Tox21_111041 | 6,3-Ionene | HEXADIMETHRIN BROMIDE FOR PROTEIN | SCHEMBL1650408 | NSC-1180
Specifications & Purity
≥90%
Storage Temp
Store at 2-8°C,Argon charged
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Product Description
Application
Antiheparin agent. A 3mg quantity has been found to enhance peptide degradation in automated sequential analysis.
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organic nitrogen compounds
Class
Organonitrogen compounds
Subclass
Amines
Intermediate Tree Nodes
Tertiary amines
Direct Parent
Trialkylamines
Alternative Parents
Organopnictogen compounds Organobromides Hydrocarbon derivatives Alkyl bromides
Molecular Framework
Not available
Substituents
Tertiary aliphatic amine - Organopnictogen compound - Hydrocarbon derivative - Organobromide - Organohalogen compound - Alkyl halide - Alkyl bromide - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as trialkylamines. These are organic compounds containing a trialkylamine group, characterized by exactly three alkyl groups bonded to the amino nitrogen.
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
1,3-dibromopropane;N,N,N',N'-tetramethylhexane-1,6-diamine
INCHI
InChI=1S/C10H24N2.C3H6Br2/c1-11(2)9-7-5-6-8-10-12(3)4;4-2-1-3-5/h5-10H2,1-4H3;1-3H2
InChIKey
KZKAYEGOIJEWQB-UHFFFAOYSA-N
Smiles
CN(C)CCCCCCN(C)C.C(CBr)CBr
Isomeric SMILES
CN(C)CCCCCCN(C)C.C(CBr)CBr
Reaxy-Rn
24865726
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=24865726&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Sensitivity
Moisture sensitive.
Molecular Weight
374.200 g/mol
XLogP3
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
9
Exact Mass
374.076 Da
Monoisotopic Mass
372.078 Da
Topological Polar Surface Area
6.500 Ų
Heavy Atom Count
17
Formal Charge
0
Complexity
90.200
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
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
2
Citations of This Product
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2 Citations
I2212039