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SPERMINEDIHYDRATE - 97%, high purity , CAS No.403982-64-9

COA

Grade & Purity:

≥97%

Cas Number: 403982-64-9
Molecular Weight: 238.37
Beilstein Registry Number: 7526933
EC Number: 200-754-2
MDL number: MFCD01459904
PubChem CID: 20849112

In stock

Item Number

S134151

Grouped product items
SKU	Size	Availability	Price	Qty
S134151-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$61.90

Basic Description

Synonyms	DTXSID20610069 \| Spermine dihydrate \| (N,N)-1,4-butanediamine dihydrate \| Gerontine dihydrate \| N1,N1'-(butane-1,4-diyl)dipropane-1,3-diamine dihydrate \| S-7420 \| N,N'-Bis-(3-Aminopropyl)-1,4-Butanediamine Hydrate \| N1,N1'-(Butane-1,4-diyl)bis(propane-1,3
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 Organic nitrogen compounds
  - Class Organonitrogen compounds
    - Subclass Amines
      - Level5 Secondary amines
        Level6 Dialkylamines

Kingdom	Organic compounds
Superclass	Organic nitrogen compounds
Class	Organonitrogen compounds
Subclass	Amines
Intermediate Tree Nodes	Secondary amines
Direct Parent	Dialkylamines
Alternative Parents	Organic oxides Monoalkylamines Hydrocarbon derivatives
Molecular Framework	Aliphatic acyclic compounds
Substituents	Secondary aliphatic amine - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Primary amine - Primary aliphatic amine - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as dialkylamines. These are organic compounds containing a dialkylamine group, characterized by two alkyl groups bonded to the amino nitrogen.
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	N,N'-bis(3-aminopropyl)butane-1,4-diamine;dihydrate
INCHI	InChI=1S/C10H26N4.2H2O/c11-5-3-9-13-7-1-2-8-14-10-4-6-12;;/h13-14H,1-12H2;2*1H2
InChIKey	MTNRSMVAYLLBAV-UHFFFAOYSA-N
Smiles	C(CCNCCCN)CNCCCN.O.O
Isomeric SMILES	C(CCNCCCN)CNCCCN.O.O
WGK Germany	3
PubChem CID	20849112
Molecular Weight	238.37
Beilstein	7526933

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	238.370 g/mol
XLogP3
Hydrogen Bond Donor Count	6
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	11
Exact Mass	238.237 Da
Monoisotopic Mass	238.237 Da
Topological Polar Surface Area	78.100 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	86.100
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	3

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