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Isotopically Labeled Compounds

Chemicals to which isotopes have been attached in order to label specific atoms. Isotopically labeled compounds are commonly used in synthetic chemistry, characterization techniques such as NMR, and biology.
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1 – 11 of 11 results
1

Chloroform-d, 99.8% (Isotopic), contains 1% v/v TMS

CAS: 865-49-6 Molecular Formula: CHCl3 Molecular Weight (g/mol): 120.375 MDL Number: MFCD00000827 InChI Key: HEDRZPFGACZZDS-MICDWDOJSA-N Synonym: chloroform-d,deuterochloroform,methane-d, trichloro,2h chloroform,deuterated chloroform,cdcl3,trichloromethane-d,unii-p1nw4885vt,trichloro deuterio methane,chloroform, deutero PubChem CID: 71583 ChEBI: CHEBI:85365 IUPAC Name: trichloro(deuterio)methane SMILES: C(Cl)(Cl)Cl

PubChem CID 71583
CAS 865-49-6
Molecular Weight (g/mol) 120.375
ChEBI CHEBI:85365
MDL Number MFCD00000827
SMILES C(Cl)(Cl)Cl
Synonym chloroform-d,deuterochloroform,methane-d, trichloro,2h chloroform,deuterated chloroform,cdcl3,trichloromethane-d,unii-p1nw4885vt,trichloro deuterio methane,chloroform, deutero
IUPAC Name trichloro(deuterio)methane
InChI Key HEDRZPFGACZZDS-MICDWDOJSA-N
Molecular Formula CHCl3
3

Chloroform-d, 100% (Isotopic), Thermo Scientific Chemicals

CAS: 865-49-6 Molecular Formula: CHCl3 Molecular Weight (g/mol): 120.375 MDL Number: MFCD00000827 InChI Key: HEDRZPFGACZZDS-MICDWDOJSA-N Synonym: chloroform-d,deuterochloroform,methane-d, trichloro,2h chloroform,deuterated chloroform,cdcl3,trichloromethane-d,unii-p1nw4885vt,trichloro deuterio methane,chloroform, deutero PubChem CID: 71583 ChEBI: CHEBI:85365 IUPAC Name: trichloro(deuterio)methane SMILES: C(Cl)(Cl)Cl

PubChem CID 71583
CAS 865-49-6
Molecular Weight (g/mol) 120.375
ChEBI CHEBI:85365
MDL Number MFCD00000827
SMILES C(Cl)(Cl)Cl
Synonym chloroform-d,deuterochloroform,methane-d, trichloro,2h chloroform,deuterated chloroform,cdcl3,trichloromethane-d,unii-p1nw4885vt,trichloro deuterio methane,chloroform, deutero
IUPAC Name trichloro(deuterio)methane
InChI Key HEDRZPFGACZZDS-MICDWDOJSA-N
Molecular Formula CHCl3
4

Chloroform-d, 100% (Isotopic), contains 0.03% v/v TMS

CAS: 865-49-6 Molecular Formula: CHCl3 Molecular Weight (g/mol): 120.375 MDL Number: MFCD00000827 InChI Key: HEDRZPFGACZZDS-MICDWDOJSA-N Synonym: chloroform-d,deuterochloroform,methane-d, trichloro,2h chloroform,deuterated chloroform,cdcl3,trichloromethane-d,unii-p1nw4885vt,trichloro deuterio methane,chloroform, deutero PubChem CID: 71583 ChEBI: CHEBI:85365 IUPAC Name: trichloro(deuterio)methane SMILES: C(Cl)(Cl)Cl

PubChem CID 71583
CAS 865-49-6
Molecular Weight (g/mol) 120.375
ChEBI CHEBI:85365
MDL Number MFCD00000827
SMILES C(Cl)(Cl)Cl
Synonym chloroform-d,deuterochloroform,methane-d, trichloro,2h chloroform,deuterated chloroform,cdcl3,trichloromethane-d,unii-p1nw4885vt,trichloro deuterio methane,chloroform, deutero
IUPAC Name trichloro(deuterio)methane
InChI Key HEDRZPFGACZZDS-MICDWDOJSA-N
Molecular Formula CHCl3
5

Deuterium bromide, 48% w/w in D{2}O, 99+% (Isotopic)

CAS: 13536-59-9 Molecular Formula: BrH Molecular Weight (g/mol): 81.918 MDL Number: MFCD00044232 InChI Key: CPELXLSAUQHCOX-DYCDLGHISA-N Synonym: deuterium bromide,hydrobromic acid-d,deutero-bromide,dbr solution,deuterium bromide solution,bromo 2 h,deuterium bromide, 99 atom % d,deuterium bromide w/w in d2o,deuterium bromide 98.0atom%d in d2o,deuterium bromide solution, 47 wt. % in d2o, 99 atom % d PubChem CID: 518779 SMILES: Br

PubChem CID 518779
CAS 13536-59-9
Molecular Weight (g/mol) 81.918
MDL Number MFCD00044232
SMILES Br
Synonym deuterium bromide,hydrobromic acid-d,deutero-bromide,dbr solution,deuterium bromide solution,bromo 2 h,deuterium bromide, 99 atom % d,deuterium bromide w/w in d2o,deuterium bromide 98.0atom%d in d2o,deuterium bromide solution, 47 wt. % in d2o, 99 atom % d
InChI Key CPELXLSAUQHCOX-DYCDLGHISA-N
Molecular Formula BrH
6

Chloroform-d, 99.8% (Isotopic), contains 0.03% v/v TMS

CAS: 865-49-6 Molecular Formula: CHCl3 Molecular Weight (g/mol): 120.375 MDL Number: MFCD00000827 InChI Key: HEDRZPFGACZZDS-MICDWDOJSA-N Synonym: chloroform-d,deuterochloroform,methane-d, trichloro,2h chloroform,deuterated chloroform,cdcl3,trichloromethane-d,unii-p1nw4885vt,trichloro deuterio methane,chloroform, deutero PubChem CID: 71583 ChEBI: CHEBI:85365 IUPAC Name: trichloro(deuterio)methane SMILES: C(Cl)(Cl)Cl

PubChem CID 71583
CAS 865-49-6
Molecular Weight (g/mol) 120.375
ChEBI CHEBI:85365
MDL Number MFCD00000827
SMILES C(Cl)(Cl)Cl
Synonym chloroform-d,deuterochloroform,methane-d, trichloro,2h chloroform,deuterated chloroform,cdcl3,trichloromethane-d,unii-p1nw4885vt,trichloro deuterio methane,chloroform, deutero
IUPAC Name trichloro(deuterio)methane
InChI Key HEDRZPFGACZZDS-MICDWDOJSA-N
Molecular Formula CHCl3
7

Chloroform-d, 99.8% (Isotopic)

CAS: 865-49-6 Molecular Formula: CHCl3 Molecular Weight (g/mol): 120.375 MDL Number: MFCD00000827 InChI Key: HEDRZPFGACZZDS-MICDWDOJSA-N Synonym: chloroform-d,deuterochloroform,methane-d, trichloro,2h chloroform,deuterated chloroform,cdcl3,trichloromethane-d,unii-p1nw4885vt,trichloro deuterio methane,chloroform, deutero PubChem CID: 71583 ChEBI: CHEBI:85365 IUPAC Name: trichloro(deuterio)methane SMILES: C(Cl)(Cl)Cl

PubChem CID 71583
CAS 865-49-6
Molecular Weight (g/mol) 120.375
ChEBI CHEBI:85365
MDL Number MFCD00000827
SMILES C(Cl)(Cl)Cl
Synonym chloroform-d,deuterochloroform,methane-d, trichloro,2h chloroform,deuterated chloroform,cdcl3,trichloromethane-d,unii-p1nw4885vt,trichloro deuterio methane,chloroform, deutero
IUPAC Name trichloro(deuterio)methane
InChI Key HEDRZPFGACZZDS-MICDWDOJSA-N
Molecular Formula CHCl3
9

Styrene-d{8}, 98% (Isotopic) stab. with 4-tert-butylcatechol

CAS: 19361-62-7 Molecular Formula: C8H8 Molecular Weight (g/mol): 112.201 MDL Number: MFCD00044231 InChI Key: PPBRXRYQALVLMV-GDALLCCDSA-N Synonym: styrene-d8,2h8 styrene,perdeuteriostyrene,benzene-d5, ethenyl-d3,1,2,3,4,5-pentadeuterio-6-1,2,2-trideuterioethenyl benzene,benzene-1,2,3,4,5-d5, 6-ethenyl-1,2,2-d3,styrene d8,phenethylene-d8,phenylethene-d8,vinylbenzene-d8 PubChem CID: 88025 IUPAC Name: 1,2,3,4,5-pentadeuterio-6-(1,2,2-trideuterioethenyl)benzene SMILES: C=CC1=CC=CC=C1

PubChem CID 88025
CAS 19361-62-7
Molecular Weight (g/mol) 112.201
MDL Number MFCD00044231
SMILES C=CC1=CC=CC=C1
Synonym styrene-d8,2h8 styrene,perdeuteriostyrene,benzene-d5, ethenyl-d3,1,2,3,4,5-pentadeuterio-6-1,2,2-trideuterioethenyl benzene,benzene-1,2,3,4,5-d5, 6-ethenyl-1,2,2-d3,styrene d8,phenethylene-d8,phenylethene-d8,vinylbenzene-d8
IUPAC Name 1,2,3,4,5-pentadeuterio-6-(1,2,2-trideuterioethenyl)benzene
InChI Key PPBRXRYQALVLMV-GDALLCCDSA-N
Molecular Formula C8H8
10

Pyridine-d{5}, 100%(Isotopic)

CAS: 7291-22-7 Molecular Formula: C5H5N Molecular Weight (g/mol): 84.13 MDL Number: MFCD00044639 InChI Key: JUJWROOIHBZHMG-RALIUCGRSA-N Synonym: pyridine-d5,2h5 pyridine,c5d5n,2 h? pyridine,pyridine d5,pyridine,crude,light,pyridine, perdeutero,∼2∼h_5_ pyridine,de85c PubChem CID: 558519 IUPAC Name: 2,3,4,5,6-pentadeuteriopyridine SMILES: [2H]C1=NC([2H])=C([2H])C([2H])=C1[2H]

PubChem CID 558519
CAS 7291-22-7
Molecular Weight (g/mol) 84.13
MDL Number MFCD00044639
SMILES [2H]C1=NC([2H])=C([2H])C([2H])=C1[2H]
Synonym pyridine-d5,2h5 pyridine,c5d5n,2 h? pyridine,pyridine d5,pyridine,crude,light,pyridine, perdeutero,∼2∼h_5_ pyridine,de85c
IUPAC Name 2,3,4,5,6-pentadeuteriopyridine
InChI Key JUJWROOIHBZHMG-RALIUCGRSA-N
Molecular Formula C5H5N
11

Acetonitrile-d{3}, 99.8% (Isotopic)

CAS: 2206-26-0 Molecular Formula: C2H3N Molecular Weight (g/mol): 44.07 MDL Number: MFCD00001881 InChI Key: WEVYAHXRMPXWCK-FIBGUPNXSA-N Synonym: acetonitrile-d3,2h3 acetonitrile,cd3cn,acetonitrile-2,2,2-d3,methyl-d3 cyanide,trideuteroacetonitrile,acetonitrile-d3, 99.8 atom % d,acetonitrile-d3, ≥99.8 atom % d,acetonitrile-d isotopic 5g PubChem CID: 123151 IUPAC Name: 2,2,2-trideuterioacetonitrile SMILES: [2H]C([2H])([2H])C#N

PubChem CID 123151
CAS 2206-26-0
Molecular Weight (g/mol) 44.07
MDL Number MFCD00001881
SMILES [2H]C([2H])([2H])C#N
Synonym acetonitrile-d3,2h3 acetonitrile,cd3cn,acetonitrile-2,2,2-d3,methyl-d3 cyanide,trideuteroacetonitrile,acetonitrile-d3, 99.8 atom % d,acetonitrile-d3, ≥99.8 atom % d,acetonitrile-d isotopic 5g
IUPAC Name 2,2,2-trideuterioacetonitrile
InChI Key WEVYAHXRMPXWCK-FIBGUPNXSA-N
Molecular Formula C2H3N