CAS:21658-95-7 / diisopropyl (cyanomethyl)phosphonate--Hangzhou Chempro Technology Co., Ltd.

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CAS Number: 21658-95-7
diisopropyl (cyanomethyl)phosphonate

Structure
Name: diisopropyl (cyanomethyl)phosphonate
Synonyms:

General Information

Product Number: 21658957

CAS Registry Number:

21658-95-7

Name:

Phosphonic acid, P-(cyanomethyl)-, bis(1-methylethyl) ester

Phosphonic acid, (cyanomethyl)-, bis(1-methylethyl) ester (9CI); Phosphonic acid, (cyanomethyl)-, diisopropyl ester (7CI,8CI); Diisopropyl cyanomethylphosphonate; Diisopropyl phosphonoacetonitrile

Chemical Formula: C8H16NO3P

Exact Mass: 205.09

Molecular Weight: 205.19

m/z: 205.09 (100.0%), 206.09 (9.0%)

Elemental Analysis: C, 46.83; H, 7.86; N, 6.83; O, 23.39; P, 15.10

InChI: InChI=1S/C8H16NO3P/c1-7(2)11-13(10,6-5-9)12-8(3)4/h7-8H,6H2,1-4H3

InChIKey: MQDIIJHQSUNBKA-UHFFFAOYSA-N

Canonical SMILES : CC(C)OP(=O)(CC#N)OC(C)C

Thermal Properties	Value	Condition	Note
Boiling Point	126-128 °C	Press: 0.5 Torr	(1)CAS

Specification

98%

References

(1) Bodnarchuk, N. D.; Zhurnal Obshchei Khimii 1969, V39(1), P168-72 CAPLUS
(2) Hammerschmidt, Friedrich; Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999) 1991, (2), P365-9 CAPLUS

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