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CS-W001157 4
Total: USD 88.00

2-Benzylmalonic acid

  • CAS No. 616-75-1

  • Cat. No. CS-0106201
  • Purity≥98%
  • MDL No.MFCD00004261
  • HazMat Fee +

    HazMat Fee

    An item is classified as a dangerous good if our website displays Hazardous Material (HazMat) information for it. There is a HazMat shipping fee for each item that qualifies as a dangerous good, except in the following scenarios:

    The shipment is processed through FedEx Ground under the Limited Quantity option.

    Each bottle is packed as an Excepted Quantity, with a maximum of 1g for items in class 6.1 packing group I or II, and up to 25g for all other hazardous materials.

    If shipping is charged to your FedEx account, the HazMat fee will be billed directly by the courier. Otherwise, the fee will be included on your invoice. To help you avoid the HazMat fee, we can package a 5g order of a class 6.1 packing group I or II material as five separate 1g units, and a 100g order of any other dangerous good as four 25g units. This packaging adjustment will be made unless you instruct otherwise on your purchase order. Below, you will find the fee schedule from FedEx for handling hazardous materials.

    Type
    HazMat Fee
    Excepted Quantity $0.00
    FedEx Limited Quantities Ground $0.00
    Hazmat Ground shipping $50.00+
    Inaccessible (Haz class 6.1 or 9), Domestic $68.00+
    Accessible (Haz class 3, 4, 5 or 8), Domestic $158.00+
    Inaccessible (Haz class 6.1 or 9), International $108.00+
    Accessible (Haz class 3, 4, 5 or 8), International $238.00+

    An item is classified as a dangerous good if our website displays Hazardous Material (HazMat) information for it.

    There is a HazMat shipping fee for each item that qualifies as a dangerous good. Please contact our quotation team via email to confirm the details.

*For research and further manufacturing use only, not for direct human use.

2-Benzylmalonic acid|CS-0106201

Structure of 616-75-1

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Description

2-Benzylmalonic acid features a benzylic carbon flanked by two carboxylic acid groups, enabling direct functionalization at the α-position. This structure supports facile derivatization in synthetic routes requiring activated methylene units. The molecule exhibits enhanced solubility in polar solvents compared to alkyl analogs, streamlining purification and reaction monitoring under standard conditions.

Application

2-Benzylmalonic acid serves as a versatile building block in synthetic organic chemistry, enabling the construction of substituted malonate derivatives and heterocyclic scaffolds. Its benzylic functionality enhances stability and facilitates subsequent transformations such as decarboxylation, alkylation, and cyclization. The molecule functions effectively in standard condensation reactions and demonstrates good bench stability, making it well-suited for multi-step synthesis and process-scale applications.

General Information

  • CAS No. 616-75-1
  • Cat. No. CS-0106201
  • Purity ≥98%
  • MDL No. MFCD00004261
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₀O₄
  • Molecular Weight 194.18
  • Synonym(s) Propanedioic acid, (phenylmethyl)- (9CI)
  • SMILES O=C(O)C(CC1=CC=CC=C1)C(O)=O

Computational Chemistry Data

  • TPSA   74.6
  • LogP   1.0145
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   4

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

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