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411310

Sigma-Aldrich

(Carbethoxymethyl-1,2-13C2)triphenylphosphonium bromide

98 atom % 13C

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Linear Formula:
C2H5O213C13CH2P(C6H5)3Br
CAS Number:
Molecular Weight:
431.27
UNSPSC Code:
12352202
PubChem Substance ID:

isotopic purity

98 atom % 13C

Quality Level

form

solid

mol wt

431.23 by atom % calculation

reaction suitability

reaction type: C-C Bond Formation
reaction type: Whiting Reaction

mp

152-154 °C (lit.)

mass shift

M+2

SMILES string

[Br-].CCO[13C](=O)[13CH2][P+](c1ccccc1)(c2ccccc2)c3ccccc3

InChI

1S/C22H22O2P.BrH/c1-2-24-22(23)18-25(19-12-6-3-7-13-19,20-14-8-4-9-15-20)21-16-10-5-11-17-21;/h3-17H,2,18H2,1H3;1H/q+1;/p-1/i18+1,22+1;

InChI key

VJVZPTPOYCJFNI-WWPGYFPTSA-M

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

Precautionary Statements

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Regulatory Information

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Certificates of Analysis (COA)

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