Cas no 13910-49-1 ((3-Aminopropyl)(benzyl)methylamine)

3-Aminopropyl)(benzyl)methylamine is a versatile amine compound featuring both primary and tertiary amine functionalities, making it a valuable intermediate in organic synthesis and pharmaceutical applications. Its structure, incorporating a benzyl group and an aminopropyl chain, allows for selective reactivity in nucleophilic substitution and reductive amination reactions. The compound is particularly useful in the preparation of chelating agents, surfactants, and specialty polymers. Its dual amine sites enable efficient crosslinking in epoxy and polyurethane systems, enhancing material properties. The product is typically supplied as a clear liquid with moderate viscosity, ensuring ease of handling in industrial processes. Proper storage under inert conditions is recommended to maintain stability.
(3-Aminopropyl)(benzyl)methylamine structure
13910-49-1 structure
Product Name:(3-Aminopropyl)(benzyl)methylamine
CAS No:13910-49-1
MF:C11H18N2
MW:178.274022579193
MDL:MFCD03001135
CID:235579
PubChem ID:4962836
Update Time:2025-10-28

(3-Aminopropyl)(benzyl)methylamine Chemical and Physical Properties

Names and Identifiers

    • N1-Benzyl-N1-methylpropane-1,3-diamine
    • 1,3-Propanediamine, N1-methyl-N1-(phenylmethyl)-
    • N-(3-AMINOPROPYL)-N-BENZYL-N-METHYLAMINE
    • N1-Benzyl-N1-methyl-1,3-propanediamine
    • N'-benzyl-N'-methylpropane-1,3-diamine
    • 3-Benzyl-3-methylaminopropylamine
    • HMS1788D02
    • N-Benzyl-N-methyl-propandiyldiamin
    • N-benzyl-N-methyl-propanediyldiamine
    • N-benzyl-N-methylpropane-1,3-diamine
    • N-methyl-N-(phenylmethyl)propane-1,3-diamine
    • N-benzyl-N-methylpropane-1,3-diamine(SALTDATA: FREE)
    • N-(3-Aminopropyl-N
    • AKOS000201033
    • EN300-14111
    • N-(3-Aminopropyl)-N-benzyl-N-methylamine, AldrichCPR
    • BS-13762
    • 13910-49-1
    • MFCD03001135
    • N~1~-Benzyl-N~1~-methylpropane-1,3-diamine
    • A907966
    • Z96092423
    • N-(3-Aminopropyl)-N-benzyl-N-metylamine
    • DTXSID80407174
    • SCHEMBL2108172
    • (3-aminopropyl)(benzyl)methylamine
    • CS-0308927
    • ALBB-021026
    • 1,3-Propanediamine, N-methyl-N-(phenylmethyl)-
    • G37831
    • (3-Aminopropyl)(benzyl)methylamine
    • MDL: MFCD03001135
    • Inchi: 1S/C11H18N2/c1-13(9-5-8-12)10-11-6-3-2-4-7-11/h2-4,6-7H,5,8-10,12H2,1H3
    • InChI Key: LZQYISZOMMPPIP-UHFFFAOYSA-N
    • SMILES: N(C)(CC1C=CC=CC=1)CCCN

Computed Properties

  • Exact Mass: 178.14700
  • Monoisotopic Mass: 180.162649
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 5
  • Complexity: 119
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 32.1
  • XLogP3: 1.2

Experimental Properties

  • Density: 0.975
  • Melting Point: 16-18 °C
  • Boiling Point: 260.9°Cat760mmHg
  • Flash Point: 104.1°C
  • PSA: 29.26000
  • LogP: 2.16750
  • Vapor Pressure: 0.0±0.5 mmHg at 25°C

(3-Aminopropyl)(benzyl)methylamine Security Information

  • Symbol: GHS07
  • Signal Word:Warning
  • Hazard Statement: H302-H319
  • Warning Statement: P305+P351+P338
  • Hazardous Material transportation number:NONH for all modes of transport
  • Hazard Category Code: 36
  • Safety Instruction: 26
  • Storage Condition:storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)

(3-Aminopropyl)(benzyl)methylamine Customs Data

  • HS CODE:2921590090
  • Customs Data:

    China Customs Code:

    2921590090

    Overview:

    2921590090. Other aromatic polyamines and derivatives and their salts. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2921590090. other aromatic polyamines and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

(3-Aminopropyl)(benzyl)methylamine Pricemore >>

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Additional information on (3-Aminopropyl)(benzyl)methylamine

Professional Introduction to (3-Aminopropyl)(benzyl)methylamine and CAS No. 13910-49-1

(3-Aminopropyl)(benzyl)methylamine) is a specialized organic compound characterized by its unique structural and chemical properties. This compound, identified by the CAS number CAS No. 13910-49-1, has garnered significant attention in the field of pharmaceutical chemistry and biotechnology due to its versatile applications. The molecular structure of this amine derivative consists of a propyl chain linked to a benzyl group, with an additional methylamine moiety, making it a valuable intermediate in the synthesis of various bioactive molecules.

The compound's significance lies in its ability to serve as a building block for more complex molecules, particularly in the development of drugs targeting neurological and inflammatory disorders. Recent advancements in medicinal chemistry have highlighted the potential of (3-aminopropyl)(benzyl)methylamine as a precursor for novel therapeutic agents. Its dual functionality allows for selective modifications, enabling chemists to tailor its properties for specific biological interactions.

In the realm of drug discovery, (3-aminopropyl)(benzyl)methylamine has been explored for its role in modulating enzyme activity and receptor binding. Studies have demonstrated its efficacy in interactions with enzymes such as kinases and phosphodiesterases, which are crucial in cellular signaling pathways. The benzyl group enhances solubility and bioavailability, while the propyl chain provides a scaffold for further functionalization, making it an attractive candidate for drug design.

Recent research has also delved into the compound's potential as a chiral auxiliary in asymmetric synthesis. The presence of stereogenic centers in (3-aminopropyl)(benzyl)methylamine allows for the synthesis of enantiomerically pure compounds, which are often required for optimal pharmacological activity. This has opened new avenues in the development of enantiomerically enriched drugs with improved therapeutic profiles.

The pharmaceutical industry has shown particular interest in (3-aminopropyl)(benzyl)methylamine due to its role in synthesizing novel antiviral and anti-inflammatory agents. Its structural features facilitate the creation of molecules that can interact with viral proteases or inflammatory cytokines, offering potential treatments for emerging infectious diseases and chronic inflammatory conditions. The compound's versatility has also been leveraged in designing prodrugs that enhance drug delivery and release mechanisms.

Beyond pharmaceutical applications, (3-aminopropyl)(benzyl)methylamine finds utility in agrochemical research, where it serves as a precursor for herbicides and pesticides with improved environmental compatibility. Its ability to undergo selective chemical transformations allows researchers to develop compounds that target specific enzymatic pathways in pests while minimizing harm to non-target organisms.

The synthesis of (3-aminopropyl)(benzyl)methylamine) involves multi-step organic reactions that require precise control over reaction conditions to ensure high yield and purity. Advanced synthetic methodologies, including catalytic hydrogenation and palladium-catalyzed cross-coupling reactions, have been employed to optimize its production. These techniques not only enhance efficiency but also reduce waste, aligning with green chemistry principles.

The compound's stability under various conditions has been thoroughly investigated, ensuring its suitability for industrial-scale applications. Studies have focused on its behavior under different pH levels, temperatures, and solvent systems, providing valuable data for formulating stable and effective derivatives. This has been particularly important for developing drug formulations that maintain efficacy during storage and transportation.

In conclusion, (3-aminopropyl)(benzyl)methylamine) is a multifaceted compound with broad applications in pharmaceuticals, agrochemicals, and material science. Its unique structural features make it an indispensable tool for synthetic chemists seeking to develop innovative bioactive molecules. As research continues to uncover new possibilities, the importance of this compound is set to grow further, driving advancements across multiple scientific disciplines.

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