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Nitrobenzene-d5

ALDRICH/151955 - 99.5 atom % D

Synonym: Pentadeuteronitrobenzene

CAS Number: 4165-60-0
Empirical Formula (Hill Notation): C6D5NO2
Molecular Weight: 128.14
EC Number: 224-014-3
MDL Number: MFCD00044415
Linear Formula: C6D5NO2
Product Type: Chemical
Catalog Number PKG Qty. Price Quantity
45-151955-5G 5 g
 $78.40
1/EA		 Add To Favorites
45-151955-25G 25 g
 $0.00
1/EA
CALL FOR PRICE		 Add To Favorites

 

assay 99% (CP)
bp 88 °C/12 mmHg (lit.)
density 1.253 g/mL at 25 °C (lit.)
expl. lim. 0.34-6.3 % (lit.)
form liquid
impurities ≤0.5% water
water
InChI 1S/C6H5NO2/c8-7(9)6-4-2-1-3-5-6/h1-5H/i1D,2D,3D,4D,5D
InChI key LQNUZADURLCDLV-RALIUCGRSA-N
isotopic purity 99.5 atom % D
mass shift M+5
mp 6 °C (lit.)
Quality Level 200 
refractive index n20/D 1.5498 (lit.)
SMILES string [2H]c1c([2H])c([2H])c(c([2H])c1[2H])[N+]([O-])=O
technique(s) NMR: suitable
General description: Nitrobenzene-d5 is also referred to as pentadeuteronitrobenzene. Structure of the complexes between tetramethyl p-tert-butylcalix[4]arene tetraketone and hydroxonium cation H3O+ in nitrobenzene-d5 have been investigated by NMR (Nuclear Magnetic Resonance) spectroscopy and DFT (Density Functional Theory) calculations. It participates in the preparation of 2- and 3-phenyl-d5-thiophenes.
Other Notes: Check out ChemisTwin® , our brand new online portal for identity confirmation and quantification of NMR spectra. Learn more  or reach out to us for a free trial .
Packaging: 25 g in glass bottle
Packaging: 5, 10 g in ampule
Purity 99% (CP)
bp 88 °C/12 mmHg (lit.)
mp 6 °C (lit.)
Density 1.253 g/mL at 25 °C (lit.)
Refractive Index n20/D 1.5498 (lit.)
UNSPSC 12142201

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