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4,4'-Methylene-bis(2-methylaniline) - analytical standard, high purity , CAS No.838-88-0

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4,4'-Methylene-bis(2-methylaniline) - analytical standard, high purity , CAS No.838-88-0

5 Citations

COA

Grade & Purity:

analytical standard

Cas Number: 838-88-0
Molecular Weight: 226.32
Beilstein Registry Number: 398069
EC Number: 212-658-8
MDL number: MFCD00126963
PubChem CID: 13283

In stock

Item Number

M114089

Grouped product items
SKU	Size	Availability	Price	Qty
M114089-100mg	100mg	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$138.90
M114089-500mg	500mg	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$614.90

Basic Description

Synonyms	838-88-0 \| 4,4'-Methylenebis(2-methylaniline) \| 4,4'-Diamino-3,3'-dimethyldiphenylmethane \| MBOT \| 3,3'-Dimethyl-4,4'-diaminodiphenylmethane \| ME-Mda \| 4,4'-Methylenedi-o-toluidine \| 4,4'-Methylene bis(2-methylaniline) \| 4,4'-Methylenebis(o-toluidine) \| Bis(3-methyl-4-amin
Specifications & Purity	analytical standard
Shipped In	Normal
Grade	analytical standard

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Diphenylmethanes
Intermediate Tree Nodes	Not available
Direct Parent	Diphenylmethanes
Alternative Parents	Aniline and substituted anilines Aminotoluenes Primary amines Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Diphenylmethane - Aminotoluene - Aniline or substituted anilines - Toluene - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Amine - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as diphenylmethanes. These are compounds containing a diphenylmethane moiety, which consists of a methane wherein two hydrogen atoms are replaced by two phenyl groups.
External Descriptors	diarylmethane
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

Associated Targets(Human)

EHMT2 Tchem Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 (93046 Activities)

Discover Target: EHMT2

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

GMNN Tbio Geminin (128009 Activities)

Discover Target: GMNN

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

BAZ2B Tchem Bromodomain adjacent to zinc finger domain protein 2B (56204 Activities)

Discover Target: BAZ2B

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Associated Targets(non-human)

Rattus norvegicus (775804 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

IUPAC Name	4-[(4-amino-3-methylphenyl)methyl]-2-methylaniline
INCHI	InChI=1S/C15H18N2/c1-10-7-12(3-5-14(10)16)9-13-4-6-15(17)11(2)8-13/h3-8H,9,16-17H2,1-2H3
InChIKey	WECDUOXQLAIPQW-UHFFFAOYSA-N
Smiles	CC1=C(C=CC(=C1)CC2=CC(=C(C=C2)N)C)N
Isomeric SMILES	CC1=C(C=CC(=C1)CC2=CC(=C(C=C2)N)C)N
WGK Germany	3
RTECS	BY5300000
UN Number	3077
Molecular Weight	226.32
Beilstein	398069
Reaxy-Rn	398069
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=398069&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
C23081241	Certificate of Analysis	Dec 06, 2024	M114089
C23081273	Certificate of Analysis	Dec 06, 2024	M114089
I1924117	Certificate of Analysis	Apr 11, 2023	M114089

Chemical and Physical Properties

Melt Point(°C)	155-157°C
Molecular Weight	226.320 g/mol
XLogP3	2.600
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	226.147 Da
Monoisotopic Mass	226.147 Da
Topological Polar Surface Area	52.000 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	217.000
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

Citations of This Product

How to Cite Aladdin Scientific Products? Citations Search

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