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Phenmethylammonium Iodide - ≥99.5% ( 4 Times Purification ), high purity , CAS No.45579-91-7

COA

Grade & Purity:

≥99.5%(4 Times Purification)

Cas Number: 45579-91-7
Molecular Weight: 235.07
PubChem CID: 67825834
PubChem SID: 488202103

In stock

Item Number

P493100

Grouped product items
SKU	Size	Availability	Price
P493100-250mg	250mg	4	$54.90
P493100-1g	1g	2	$160.90
P493100-5g	5g	1	$667.90

Basic Description

Synonyms	Benzylamine Hydroiodide \| 45579-91-7 \| phenylmethanamine;hydroiodide \| Benzylamine Hydroiodide (Low water content) \| benzylammonium iodide \| Benzylaminhydrojodid \| SCHEMBL9324482 \| VBA57991 \| MFCD28384135 \| LS-13288 \| B4566 \| T70936
Specifications & Purity	≥99.5%(4 Times Purification)
Storage Temp	Room temperature,Argon charged
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Phenylmethylamines

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Phenylmethylamines
Intermediate Tree Nodes	Not available
Direct Parent	Phenylmethylamines
Alternative Parents	Benzylamines Aralkylamines Quaternary ammonium salts Organic iodide salts Monoalkylamines Hydrocarbon derivatives Organic cations
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Phenylmethylamine - Benzylamine - Aralkylamine - Quaternary ammonium salt - Organic nitrogen compound - Hydrocarbon derivative - Organic iodide salt - Organic salt - Primary amine - Organonitrogen compound - Primary aliphatic amine - Amine - Organic cation - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as phenylmethylamines. These are compounds containing a phenylmethtylamine moiety, which consists of a phenyl group substituted by an methanamine.
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	488202103
IUPAC Name	phenylmethanamine;hydroiodide
INCHI	InChI=1S/C7H9N.HI/c8-6-7-4-2-1-3-5-7;/h1-5H,6,8H2;1H
InChIKey	PPCHYMCMRUGLHR-UHFFFAOYSA-N
Smiles	C1=CC=C(C=C1)CN.I
Isomeric SMILES	C1=CC=C(C=C1)CN.I
Molecular Weight	235.07
Reaxy-Rn	3682485
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3682485&ln=

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

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

Analytical Chart:

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9 results found

Lot Number	Certificate Type	Date	Item
C2404189	Certificate of Analysis	Apr 01, 2023	P493100
F2523081	Certificate of Analysis	Apr 01, 2023	P493100
E2320466	Certificate of Analysis	Apr 01, 2023	P493100
L2424238	Certificate of Analysis	Apr 01, 2023	P493100
E2320393	Certificate of Analysis	Apr 01, 2023	P493100
E2320465	Certificate of Analysis	Apr 01, 2023	P493100
E2320392	Certificate of Analysis	Apr 01, 2023	P493100
E2320402	Certificate of Analysis	Apr 01, 2023	P493100
E2320387	Certificate of Analysis	Apr 01, 2023	P493100

Chemical and Physical Properties

Solubility	High soluble in EtOH, DMF, DMSO, water et al
Sensitivity	Moisture sensitive;air sensitive;light sensitive
Melt Point(°C)	178 °C
Molecular Weight	235.070 g/mol
XLogP3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	234.986 Da
Monoisotopic Mass	234.986 Da
Topological Polar Surface Area	26.000 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	55.400
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

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