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Triethyl phosphonoacetate-[13C2]

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General Information
Catalog: BLP-010112
CAS: 100940-60-1
Molecular Formula: C6[13C]2H17O5P
Molecular Weight: 226.18

Chemical Structure

Description	Triethyl phosphonoacetate is a reagent used for Horner-Emmons modification.
Synonyms	Diethyl Ethoxycarbonylmethylphosphonate-13C2; 2-(Diethoxyphosphinyl)acetic Acid-13C2 Ethyl Ester; (Diethoxyphosphinyl)acetic Acid-13C2 Ethyl Ester; Carbethoxymethyldiethyl Phosphonate-13C2; NSC 13898-13C2; NSC 16128-13C2
IUPAC Name	ethyl 2-diethoxyphosphorylacetate
Related CAS	867-13-0 (unlabelled)
Isomeric SMILES	CCO[13C](=O)[13CH2]P(=O)(OCC)OCC
Canonical SMILES	CCOC(=O)CP(=O)(OCC)OCC
InChI	InChI=1S/C8H17O5P/c1-4-11-8(9)7-14(10,12-5-2)13-6-3/h4-7H2,1-3H3/i7+1,8+1
InChI Key	GGUBFICZYGKNTD-BFGUONQLSA-N
Boiling Point	142-145°C at 9 mmHg (lit.)
Purity	99% by CP; 99% atom 13C
Density	1.13 g/mL at 25°C (lit.)
Storage	Store at RT