Skip to the beginning of the images gallery

3-Methyl-5-nitroaniline - 96%, high purity , CAS No.618-61-1

COA

Grade & Purity:

≥96%

Cas Number: 618-61-1
Molecular Weight: 152.2
PubChem CID: 3565037
PubChem SID: 488194451

In stock

Item Number

M185591

Grouped product items
SKU	Size	Availability	Price
M185591-1g	1g	1	$49.90
M185591-250mg	250mg	1	$18.90
M185591-25g	25g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$526.90
M185591-5g	5g	1	$144.90

Discover 3-Methyl-5-nitroaniline by Aladdin Scientific in 96% for only $18.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	3-methyl-5-nitroaniline \| 618-61-1 \| 3-Methyl-5-nitro aniline \| MFCD00082655 \| 3-AMINO-5-NITROTOLUENE \| Benzenamine, 3-methyl-5-nitro- \| 3-nitro-5-methylaniline \| SCHEMBL1396 \| 3-methyl-5-nitrobenzenamine \| DTXSID30393710 \| DZIJEXQVMORGQX-UHFFFAOYSA-N \| CL8434 \| AKOS006239052 \| AM
Specifications & Purity	≥96%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Nitrobenzenes
Intermediate Tree Nodes	Not available
Direct Parent	Nitrobenzenes
Alternative Parents	Nitrotoluenes Nitroaromatic compounds Aniline and substituted anilines Aminotoluenes Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Primary amines Organic salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Nitrobenzene - Nitrotoluene - Nitroaromatic compound - Aniline or substituted anilines - Aminotoluene - Toluene - C-nitro compound - Organic nitro compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic oxide - Primary amine - Organonitrogen compound - Amine - Organic nitrogen compound - Organic oxygen compound - Organic salt - Hydrocarbon derivative - Organic cation - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group.
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	488194451
IUPAC Name	3-methyl-5-nitroaniline
INCHI	InChI=1S/C7H8N2O2/c1-5-2-6(8)4-7(3-5)9(10)11/h2-4H,8H2,1H3
InChIKey	DZIJEXQVMORGQX-UHFFFAOYSA-N
Smiles	CC1=CC(=CC(=C1)[N+](=O)[O-])N
Isomeric SMILES	CC1=CC(=CC(=C1)[N+](=O)[O-])N
Molecular Weight	152.2
Reaxy-Rn	2690558
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2690558&ln=

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

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

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

3 results found

Lot Number	Certificate Type	Date	Item
A2224230	Certificate of Analysis	Nov 06, 2024	M185591
A2224225	Certificate of Analysis	Nov 06, 2024	M185591
A2224226	Certificate of Analysis	Nov 06, 2024	M185591

Chemical and Physical Properties

Molecular Weight	152.150 g/mol
XLogP3	1.400
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	152.059 Da
Monoisotopic Mass	152.059 Da
Topological Polar Surface Area	71.800 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	155.000
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	1

Solution Calculators

Molarity Calculator

Determine the necessary mass, volume, or concentration for preparing a solution.

Mass

Concentration

Volume

M. Wt*

g/mol

*When preparing stock solutions, always use the batch-specific molecular weight of the product found on the vial label and the Certificate of Analysis (available online).

Dilution Calculator

Determine the dilution needed to prepare a stock solution.

Concentration 1 (C1)

Volume 1 (V1)

Concentration 2 (C2)

Volume 2 (V2)

Reconstitution Calculator

The reconstitution calculator enables you to quickly determine the volume of a reagent needed to reconstitute your vial. Just enter the mass of the reagent and the target concentration, and the calculator will do the rest.

Volume (to add to vial)

Mass (in vial)

Desired Reconstitution Concentration