1,2-Benzenediamine, 3-methyl-


Chemical Name: 1,2-Benzenediamine, 3-methyl-
CAS Number: 2687-25-4
Product Number: AG003B3R(AGN-PC-0JKDJY)
Synonyms:
MDL No:
Molecular Formula: C7H10N2
Molecular Weight: 122.1677

Identification/Properties


Properties
MP:
59-65 °C(lit.)
BP:
255°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Refractive Index:
1.5103 (estimate)
Computed Properties
Molecular Weight:
122.171g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
122.084g/mol
Monoisotopic Mass:
122.084g/mol
Topological Polar Surface Area:
52A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
92.9
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302+H312+H332-H315-H319-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



3-Methylbenzene-1,2-diamine is a versatile compound widely used in chemical synthesis. It serves as a crucial building block in the preparation of various organic molecules and complex structures. Due to its unique chemical properties, 3-Methylbenzene-1,2-diamine is particularly employed in the pharmaceutical and agrochemical industries for the synthesis of bioactive compounds and pesticides. Its ability to undergo selective substitution reactions makes it a valuable reagent in the development of new drugs and crop protection agents. Additionally, 3-Methylbenzene-1,2-diamine is utilized in the production of dyes and pigments, where its aromatic nature contributes to the vibrant coloration of the final products. In the field of materials science, this compound finds application as a monomer for the synthesis of polymeric materials with tailored properties. With its diverse applications across various industries, 3-Methylbenzene-1,2-diamine plays a critical role in advancing chemical synthesis and innovation.