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460656

Sigma-Aldrich

mono-Benzyl malonate

95%

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About This Item

Linear Formula:
C6H5CH2O2CCH2CO2H
CAS Number:
40204-26-0
Molecular Weight:
194.18
MDL number:
MFCD00138132
UNSPSC Code:
12352100
PubChem Substance ID:
24869724
NACRES:
NA.22

Assay

95%

form

solid

mp

47-51 °C (lit.)

SMILES string

OC(=O)CC(=O)OCc1ccccc1

InChI

1S/C10H10O4/c11-9(12)6-10(13)14-7-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,12)

InChI key

CFLAHQSWDKNWPW-UHFFFAOYSA-N

Related Categories

General description

mono-Benzyl malonate can be synthesized by the reaction of Meldrum′s acid (2,2-dimethyl- 1,3-dioxane-4,6-dione) with benzyl alcohol.

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Certificates of Analysis (COA)

Lot/Batch Number
BGBC2243V
BGBC1201V
BGBB6138V
BGBB044
MKBB8847

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A potential suicide inhibitor of adenylosuccinate lyase.
Hartgers A, et al.
Nucleosides and Nucleotides, 11(2), 1325-1332 (1992)

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