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2,5-diazabicyclo[2.2.1]heptane;dihydrochloride - 97%, high purity , CAS No.89487-38-7

COA

Grade & Purity:

≥97%

Cas Number: 89487-38-7
MDL number: MFCD26142215
PubChem CID: 67696715

In stock

Item Number

D635001

Grouped product items
SKU	Size	Availability	Price	Qty
D635001-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$183.90
D635001-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$921.90

Basic Description

Synonyms	2,5-Diazabicyclo[2.2.1]heptane dihydrochloride \| 89487-38-7 \| 2,5-Diaza-bicyclo[2.2.1]heptane dihydrochloride \| 2,5-diazabicyclo[2.2.1]heptane \| dihydrochloride \| (1R,4R)-2,5-Diaza-bicyclo[2.2.1]heptanedihydrochloride \| SCHEMBL8805045 \| AKOS027383919 \| SB
Specifications & Purity	≥97%
Storage Temp	Store at 2-8°C
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Diazinanes
    - Subclass Piperazines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Diazinanes
Subclass	Piperazines
Intermediate Tree Nodes	Not available
Direct Parent	Piperazines
Alternative Parents	Pyrrolidines Dialkylamines Azacyclic compounds Organopnictogen compounds Hydrochlorides Hydrocarbon derivatives
Molecular Framework	Aliphatic heteropolycyclic compounds
Substituents	Piperazine - Pyrrolidine - Azacycle - Secondary amine - Secondary aliphatic amine - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Hydrochloride - Organonitrogen compound - Amine - Aliphatic heteropolycyclic compound
Description	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
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

Names and Identifiers

IUPAC Name	2,5-diazabicyclo[2.2.1]heptane;dihydrochloride
INCHI	InChI=1S/C5H10N2.2ClH/c1-4-2-6-5(1)3-7-4;;/h4-7H,1-3H2;2*1H
InChIKey	PIDOCGDMKRSJMT-UHFFFAOYSA-N
Smiles	C1C2CNC1CN2.Cl.Cl
Isomeric SMILES	C1C2CNC1CN2.Cl.Cl
PubChem CID	67696715

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	171.070 g/mol
XLogP3
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	170.038 Da
Monoisotopic Mass	170.038 Da
Topological Polar Surface Area	24.100 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	72.100
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	3

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