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CS-W001157 4
Total: USD 88.00

tert-Butyl hydrogen malonate

  • CAS No. 40052-13-9

  • Cat. No. CS-D1454
  • Purity≥95%
  • MDL No.MFCD00191886

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

tert-Butyl hydrogen malonate|CS-D1454

Structure of 40052-13-9

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General Information

  • CAS No. 40052-13-9
  • Cat. No. CS-D1454
  • Purity ≥95%
  • MDL No. MFCD00191886
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₂O₄
  • Molecular Weight 160.17
  • Synonym(s) Malonic acid mono-tert-butyl ester; Malonic acid tert-butyl monoester; Mono-tert-butyl malonate; TERT-BUTYL MALONATE; tert-Butyl hydrogen malonate
  • SMILES O=C(OC(C)(C)C)CC(O)=O

Description

Mono-tert-Butyl malonates is an ester. It is reported to be an aminoacylase inhibitor. Preparation of mono-tert-Butyl malonates has been described.Mono-tert-Butyl malonates may be used in the preparation of the following:dendritic precursor to asymmetric methanofullerenes hapten-3,6-(O,S-dimethylthiophosphoramido)-6-oxohexanoic acid hapten-4,3-(O,S-dimethylthiophosphoramido)-3-oxopropanoic acid

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06,GHS05
Signal Word : Danger
UN#: 2927
Class : 6.1(8)
Packing Group : Ⅱ
Hazard Statements : H330-H227-H314
Precautionary Statements : P210-P260-P264-P271-P280-P284-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P320-P363-P370+P378-P403+P233-P403+P235-P405-P501

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Computational Chemistry Data

  • TPSA   63.6
  • LogP   0.8028
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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