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Indole-d4

CAT: 0804-HY-W713126-01Size: 2.5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-W713126-01Size:2.5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Indole-d4 is the deuterium labeled Indole. Indole is an aromatic, heterocyclic, organic compound which widely distributed in the natural environment and can be produced by a variety of bacteria. Indole regulates various aspects of bacterial physiology, including spore formation, plasmid stability, resistance to drugs, biofilm formation, and virulence as an intercellular signal molecule[1].
CAS Number
73509-22-5
UNSPSC
12352005
Target
Endogenous Metabolite; Isotope-Labeled Compounds
Related Pathways
Metabolic Enzyme/Protease; Others
Field of Research
Infection
Smiles
[2H]C1=C2C(NC=C2)=C(C([2H])=C1[2H])[2H]
Molecular Formula
C8H3D4N
Molecular Weight
121.17
Shipping Conditions
Room temperature
Scientific Category
Isotope-Labeled Compounds
Clinical Information
No Development Reported

Chemical Information

Indole-4,5,6,7-d4
CAS Number73509-22-5
PubChem CID11542778
IUPAC Name4,5,6,7-tetradeuterio-1H-indole
Molecular FormulaC8H7N
Molecular Weight121.17
XLogP2.1
Topological Polar Surface Area15.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Heavy Atom Count9
Formal Charge0
Complexity101
SMILES
[2H]C1=C(C(=C2C(=C1[2H])C=CN2)[2H])[2H]
InChI
InChI=1S/C8H7N/c1-2-4-8-7(3-1)5-6-9-8/h1-6,9H/i1D,2D,3D,4D
InChIKey
SIKJAQJRHWYJAI-RHQRLBAQSA-N
Chemical Structure
2D Structure
2D structure of Indole-4,5,6,7-d4
CAS: 73509-22-5
CID: 11542778
Formula: C8H7N
MW: 121.17
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight121.17
XLogP32.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass121.082956211
Monoisotopic Mass121.082956211
Topological Polar Surface Area15.8 Ų
Heavy Atom Count9
Formal Charge0
Complexity101
Isotope Atom Count4
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
AR-D07456-01Dolasetron-d4 (Indole-d4)
AR-D07454-01Dolasetron Impurity 4-d4 (Indole-d4)
sc-280833Indole-3-butyric Acid-d4
AR-D07455-01Dolasetron Impurity 5-d4 (Indole-3-Carboxylic Acid-d4)
452356-01Indole-4,5,6,7-d4
I0797-87DIndomethacin-d4 (1- (4-Chlorobenzoyl-d4) -5-methoxy-2-methyl-1H-indole-3-acetic Acid, Indometacin-d4, Bonidon-d4, Catlep-d4, Indomethine-d4, Inacid-d4, Indomod-d4)
MBS6041622-01Indomethacin-d4 (1-(4-Chlorobenzoyl-d4)-5-methoxy-2-methyl-1H-indole-3-acetic Acid, Indometacin-d4, Bonidon-d4, Catlep-d4, Indomethine-d4, Inacid-d4, Indomod-d4)
434668-015-​ (Phenylmethoxy) ​-1H-​indole-​3-​ethan-​α, ​α, ​β, ​β-​d4-​ol
408575-011-[2- (4-Morpholinyl) ethyl-d4]-3- (1-naphthoyl) indole JWH 200-d4
TRC-M723767-1MG1-[2-(4-Morpholinyl)ethyl-d4]-3-(1-naphthoyl)indole JWH 200-d4

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