CAS:104097-04-3 / diethyl 3-nitrobenzylphosphonate--Hangzhou Chempro Technology Co., Ltd.

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CAS Number: 104097-04-3
diethyl 3-nitrobenzylphosphonate

Structure
Name: diethyl 3-nitrobenzylphosphonate
Synonyms:

General Information

Product Number: 104097043

CAS Registry Number: 104097-04-3

Name:

Phosphonic acid, P-[(3-nitrophenyl)methyl]-, diethyl ester

Phosphonic acid, [(3-nitrophenyl)methyl]-, diethyl ester (9CI); Phosphonic acid, m-nitrobenzyl-, diethyl ester (6CI); Diethyl (3-nitrobenzyl)phosphonate

Chemical Formula: C11H16NO5P

Exact Mass: 273.08

Molecular Weight: 273.22

m/z: 273.08 (100.0%), 274.08 (12.3%), 275.08 (1.7%)

Elemental Analysis: C, 48.36; H, 5.90; N, 5.13; O, 29.28; P, 11.34

InChI: InChI=1S/C11H16NO5P/c1-3-16-18(15,17-4-2)9-10-6-5-7-11(8-10)12(13)14/h5-8H,3-4,9H2,1-2H3

InChIKey: QNHAEKQJZUMZFT-UHFFFAOYSA-N

Canonical SMILES : CCOP(=O)(CC1=CC(=CC=C1)[N+](=O)[O-])OCC

Thermal Properties	Value	Condition	Note
Boiling Point	173 °C	Press: 0.3 Torr	(1)CAS

Specification

98%

References

(1) Kreutzkamp, N.; Archiv der Pharmazie und Berichte der Deutschen Pharmazeutischen Gesellschaft 1961, V294, P49-56 CAPLUS

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