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151823

Chloroform-d

99.8 atom % D

Synonym(s):

Deuterochloroform

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About This Item

Linear Formula:
CDCl3
CAS Number:
865-49-6
Molecular Weight:
120.38
UNSPSC Code:
12142201
NACRES:
NA.21
PubChem Substance ID:
24849167
EC Number:
212-742-4
Beilstein/REAXYS Number:
1697633
MDL number:
MFCD00000827
Isotopic purity:
99.8 atom % D
Assay:
≥99% (CP)
Mass shift:
M+1
Form:
liquid
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isotopic purity

99.8 atom % D

assay

≥99% (CP)

form

liquid

technique(s)

NMR: suitable

refractive index

n20/D 1.444 (lit.)

bp

60.9 °C (lit.)

mp

−64 °C (lit.)

density

1.500 g/mL at 25 °C (lit.)

mass shift

M+1

SMILES string

[2H]C(Cl)(Cl)Cl

InChI

1S/CHCl3/c2-1(3)4/h1H/i1D

InChI key

HEDRZPFGACZZDS-MICDWDOJSA-N

General description

Chloroform-d (Deuterochloroform, CDCl3), deuterated chloroform, is a standard purity solvent for NMR (Nuclear Magnetic Resonance) analyses. It is widely employed in high resolution NMR studies due to its high chemical and isotopic purity. Quantitaive infrared spectral investigations of carbon-deuterium stretching bands of chloroform-d in various organic solvents have been reported. Raman difference spectroscopic studies of mixtures of chloroform-d and liquid chloroform have been conducted to evaluate frequency shifts in the ν1 and ν2 bands of CHCl3 and CDCl3.

Application

Chloroform-d has been employed as solvent in a 1H NMR (Proton Nuclear Magnetic Resonance) spectroscopic study. It has been employed as solvent during the 31PNMR (Phosphorus-31 nuclear magnetic resonance) spectral investigation of triphenyl phosphate and tris(2-chloroethyl) phosphate. It has also been used as the deuterated solvent in the 1H NMR spectral studies of 2-(4-bromobenzyl)-3-hydroxypropanoic acid and 3-hydroxy-2-(4-methoxybenzyl)propanoic acid. It has also been used as the deuterated solvent for the 1HNMR spectral studies of 3,3′-dihydroxy-4,4′-diamino-biphenyl (HAB) and 2,2′-bis-(3,4-dicarboxy-phenyl) hexafluoropropane dianhydride (6FDA) polyimide.

Other Notes

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pictograms

Skull and crossbonesHealth hazard
GHS06,GHS08

signalword

Danger

target_organs

Central nervous system, Liver,Kidney

Storage Class

6.1D - Non-combustible acute toxic Cat.3 / toxic hazardous materials or hazardous materials causing chronic effects

flash_point_f

does not flash

flash_point_c

does not flash

ppe

Eyeshields, Faceshields, Gloves

Hazard Classifications

Acute Tox. 3 Inhalation - Acute Tox. 4 Oral - Carc. 2 - Eye Irrit. 2 - Repr. 2 - Skin Irrit. 2 - STOT RE 1 - STOT SE 3

Regulatory Information

美国出口管控产品
危险化学品

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Certificates of Analysis (COA)

Lot/Batch Number
STBK3505
STBK1944
STBK1011
STBK1010
STBK0380

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Articles

溶剂混溶性表

如果物质相互溶解形成均匀的溶液，就可以说它们相互混溶。收藏或下载我们的常见实验室溶剂混溶性表。

NMR Deuterated Solvent Properties Reference Chart

Use this reference table to find the coupling values and chemical shifts of our NMR (deuterated) solvents. Melting and boiling points, molecular weight, density, and CAS number are also listed.

Solvent Miscibility Table

Substances are said to be miscible in one another if they dissolve to form a uniform solution. Bookmark or download our miscibility table for common lab solvents.

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Nuclear Magnetic Resonance (NMR)

NMR spectroscopy elucidates molecular structure and purity via nuclear spin states in a strong magnetic field.

NMR Solvents

Widest range of NMR solvents with excellent chemical purity and the highest isotopic enrichment possible.

Gas sorption and characterization of thermally rearranged polyimides based on 3, 3'-dihydroxy-4, 4'-diamino-biphenyl (HAB) and 2, 2'-bis-(3, 4-dicarboxyphenyl) hexafluoropropane dianhydride (6FDA)
Smith.PZ, et al.
Journal of Membrane Science, 415, 558-567 (2012)
Selective synthesis of 3-hydroxy acids from Meldrum's acids using SmI2-H2O
Szostak M, et al.
Nature Protocols, 7(5), 970-977 (2012)
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Global Trade Item Number

SKUGTIN
431966-1G04061832108520
431966-25G04061832108537
431966-5G04061832108544
151823-1.5KG04061838151247
151823-10X100G-N04061837648892
151823-10X1ML-N04061837613111
151823-150G04061837648915
151823-1KG04061838739636
151823-250G04061837648939
151823-100G04061837648878
151823-10X0.6ML04061838739605
151823-10X0.6ML-N04061837613104
151823-10X0.75ML04061838739612
151823-10X1ML04061838739629
151823-10X50G-N04061837648908
151823-50G04061838739643