DIETHYL (1-CYANOETHYL)PHOSPHONATE

CAS No.
29668-61-9
CCD No.
CCD00222498
Formula
C7 H14 N O3 P
MolWeight
191.166

Basic Information

Product Name: DIETHYL (1-CYANOETHYL)PHOSPHONATE
CAS: 29668-61-9
English Synonyms: (1-CYANOETHYL)PHOSPHONIC ACID DIETHYL ESTER ; 2-DIETHOXYPHOSPHORYLPROPANENITRILE ; DIETHYL (1-CYANOETHYL)PHOSPHONATE
MDL Number.: MFCD01457302
H bond acceptor: 4
H bond donor: 0
Smile: CCOP(=O)(C(C)C#N)OCC
InChi: InChI=1S/C7H14NO3P/c1-4-10-12(9,11-5-2)7(3)6-8/h7H,4-5H2,1-3H3
InChiKey: InChIKey=UMLWEPGSWQNXQX-UHFFFAOYSA-N

Property

Boiling Point: 140-141 DEG C/11 MMHG(LIT)
Density: DENSITY: 1.085 G/ML AT 25 DEG C(LIT)
Physical Property: FLASHPOINT: 113 DEG C
FLASHPOINT: 235.4 DEG F
REFRACTIVE INDEX: N20/D 1.432(LIT)
Comments: APPLICATION: REACANT FOR: PREPARATION OF SPHINGOSINE PHOSPHATE RECEPTOR (S1P) AGONISTS WITH N-CINNAMYL-ALANINE MOIETY. PREPARATION OF BENZYL- AND BENZOYLDIMETHYLAMINOPYRIDINONES AS HIV-1 REVERSE TRANSCRIPTASE INHIBITORS. STEREOSELECTIVE PREPARATION OF CYANO(TRIFLUOROMETHYL)PENTENENITRILES VIA ALKYLATION, FOLLOWED BY ELIMINATION REACTION. SYNTHESIS OF [(METHYLENEPIPERIDINYL) OR (METHYLENEPYRROLIDINYL)FLUOROPHENYL]OXAZOLIDINONE ANTIBACTERIAL AGENTS. HORNER-WADSWORTH-EMMONS OLEFINATION
NSC 135193
UNSPSC: 12352103
WGK: 3

Safety information

Symbol: GHS07 GHS07
Signal word: Warning
Hazard statements: H315-H319-H335
Precautionary statements: P261-P305 + P351 + P338
hazard symbol: Xi
Risk Code: R:36/37/38
Safe Code: S:26-36
WGK Germany: 3

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