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Safety Information

488771

Sigma-Aldrich

Diethyl malonate-1,2,3-13C3

99 atom % 13C

Synonym(s):

13C Labeled diethyl malonate, 13C Labeled diethyl malonic acid, Malonic acid diethyl ester-13C3

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About This Item

Linear Formula:
13CH2(13CO2C2H5)2
CAS Number:
Molecular Weight:
163.15
MDL number:
UNSPSC Code:
12352101
PubChem Substance ID:
NACRES:
NA.12

isotopic purity

99 atom % 13C

Quality Level

Assay

99% (CP)

refractive index

n20/D 1.414 (lit.)

bp

199 °C (lit.)

mp

−51-−50 °C (lit.)

density

1.074 g/mL at 25 °C

mass shift

M+3

SMILES string

CCO[13C](=O)[13CH2][13C](=O)OCC

InChI

1S/C7H12O4/c1-3-10-6(8)5-7(9)11-4-2/h3-5H2,1-2H3/i5+1,6+1,7+1

InChI key

IYXGSMUGOJNHAZ-SVFBATFISA-N

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Packaging

This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Statements

Hazard Classifications

Eye Irrit. 2

Storage Class Code

10 - Combustible liquids

WGK

WGK 1

Flash Point(F)

194.0 °F - closed cup

Flash Point(C)

90.00 °C - closed cup


Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

FSL

Group 4: Flammable liquids
Type 3 petroleums
Hazardous rank III
Water insoluble liquid

ISHL Indicated Name

Substances Subject to be Indicated Names

ISHL Notified Names

Substances Subject to be Notified Names

JAN Code

488771-VAR:
488771-BULK:
488771-250MG:


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Articles

Butyl methyl ether; Acetic acid; 2-Butanone; Ethyl acetate; Tetrahydrofuran; 1-Butanol; Isopropyl acetate; Heptane; Propyl acetate; 3-Methylbutanol; 4-Methyl-2-pentanone; Isobutyl acetate; Butyl acetate; Dimethyl sulfoxide; Anisole; Cumene

Protocols

US EPA Method 8260: GC Analysis of Volatiles on SPB®-624 after Purge & Trap using "K" Trap, Fast GC Analysis

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