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2-amino-4-methyl-benzaldehyde - 97%, high purity , CAS No.59236-38-3

COA

Grade & Purity:

≥97%

Cas Number: 59236-38-3
Molecular Weight: 135.16
PubChem CID: 13891184

In stock

Item Number

A638311

Grouped product items
SKU	Size	Availability	Price	Qty
A638311-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$699.90

Basic Description

Synonyms	2-AMINO-4-METHYLBENZALDEHYDE \| 59236-38-3 \| 2-Amino-4-methyl-benzaldehyde \| p-methyl amino benzaldehyde \| SCHEMBL6257642 \| MFCD10696882 \| AKOS006303878 \| AB58436 \| EN300-133035 \| Z1198276968
Specifications & Purity	≥97%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzoyl derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Benzoyl derivatives
Alternative Parents	Benzaldehydes Aniline and substituted anilines Aminotoluenes Vinylogous amides Primary amines Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Benzaldehyde - Benzoyl - Aniline or substituted anilines - Aminotoluene - Aryl-aldehyde - Toluene - Vinylogous amide - Aldehyde - Primary amine - Organooxygen compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as benzoyl derivatives. These are organic compounds containing an acyl moiety of benzoic acid with the formula (C6H5CO-).
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-amino-4-methylbenzaldehyde
INCHI	InChI=1S/C8H9NO/c1-6-2-3-7(5-10)8(9)4-6/h2-5H,9H2,1H3
InChIKey	XCDGQRLFOGCSAT-UHFFFAOYSA-N
Smiles	CC1=CC(=C(C=C1)C=O)N
Isomeric SMILES	CC1=CC(=C(C=C1)C=O)N
PubChem CID	13891184
Molecular Weight	135.16

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	135.160 g/mol
XLogP3	1.300
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	135.068 Da
Monoisotopic Mass	135.068 Da
Topological Polar Surface Area	43.100 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	124.000
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

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