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3-Dimethylamino-2-methylpropyl chloride hydrochloride - 98%, high purity , CAS No.4261-67-0

COA

Grade & Purity:

≥98%

Cas Number: 4261-67-0
Molecular Weight: 172.1
Beilstein Registry Number: 4444785
MDL number: MFCD00012514
PubChem CID: 3083841
PubChem SID: 488194249

In stock

Item Number

D134652

Grouped product items
SKU	Size	Availability	Price
D134652-5g	5g	5	$32.90
D134652-25g	25g	5	$106.90
D134652-100g	100g	2	$344.90

Basic Description

Synonyms	4261-67-0 \| 3-Dimethylamino-2-methylpropyl chloride hydrochloride \| 3-chloro-N,N,2-trimethylpropan-1-amine hydrochloride \| 3-chloro-N,N,2-trimethylpropan-1-amine;hydrochloride \| (3-CHLORO-2-METHYLPROPYL)DIMETHYLAMINE HYDROCHLORIDE \| N-(3-Chloro-2-methylpropyl)-N,N-
Specifications & Purity	≥98%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic nitrogen compounds
  - Class Organonitrogen compounds
    - Subclass Amines
      - Level5 Tertiary amines
        Level6 Trialkylamines

Kingdom	Organic compounds
Superclass	Organic nitrogen compounds
Class	Organonitrogen compounds
Subclass	Amines
Intermediate Tree Nodes	Tertiary amines
Direct Parent	Trialkylamines
Alternative Parents	Organochlorides Hydrochlorides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework	Aliphatic acyclic compounds
Substituents	Tertiary aliphatic amine - Hydrocarbon derivative - Hydrochloride - Organochloride - Organohalogen compound - Alkyl halide - Alkyl chloride - 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
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

Pubchem Sid	488194249
IUPAC Name	3-chloro-N,N,2-trimethylpropan-1-amine;hydrochloride
INCHI	InChI=1S/C6H14ClN.ClH/c1-6(4-7)5-8(2)3;/h6H,4-5H2,1-3H3;1H
InChIKey	SOMIBONUMGNAEP-UHFFFAOYSA-N
Smiles	CC(CN(C)C)CCl.Cl
Isomeric SMILES	CC(CN(C)C)CCl.Cl
PubChem CID	3083841
Molecular Weight	172.1
Beilstein	4444785

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

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

Analytical Chart:

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6 results found

Lot Number	Certificate Type	Date	Item
C2323968	Certificate of Analysis	Jan 20, 2025	D134652
C2323967	Certificate of Analysis	Jan 20, 2025	D134652
C2323978	Certificate of Analysis	Jan 20, 2025	D134652
C2323965	Certificate of Analysis	Jan 20, 2025	D134652
C2323966	Certificate of Analysis	Jan 14, 2025	D134652
C2323973	Certificate of Analysis	Jan 14, 2025	D134652

Chemical and Physical Properties

Sensitivity	Hygroscopic
Melt Point(°C)	167-170°
Molecular Weight	172.090 g/mol
XLogP3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Exact Mass	171.058 Da
Monoisotopic Mass	171.058 Da
Topological Polar Surface Area	3.200 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	54.500
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	2

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