Cas no 1219799-29-7 (Triclocarban-d4 (4-chlorophenyl-d4))

Triclocarban-d4 (4-chlorophenyl-d4) is a deuterated analog of triclocarban, a widely studied antimicrobial agent. The incorporation of four deuterium atoms at the 4-chlorophenyl positions enhances its utility as an internal standard in mass spectrometry-based analyses, ensuring improved accuracy and precision in quantitative studies. This isotopically labeled compound is particularly valuable in environmental and biomedical research, where it aids in the detection and quantification of triclocarban and its metabolites. Its high chemical purity and isotopic enrichment (>98%) make it a reliable reference material for method validation and trace-level analysis. The compound’s stability under analytical conditions further supports its use in LC-MS and GC-MS applications.
Triclocarban-d4 (4-chlorophenyl-d4) structure
1219799-29-7 structure
Product Name:Triclocarban-d4 (4-chlorophenyl-d4)
CAS No:1219799-29-7
MF:C13H9Cl3N2O
MW:319.6
CID:1066192
PubChem ID:162642047
Update Time:2025-06-13

Triclocarban-d4 (4-chlorophenyl-d4) Chemical and Physical Properties

Names and Identifiers

    • Triclocarban-d4 (4-chlorophenyl-d4)
    • Triclocarban-d
    • 3,4,4'-Trichlorocarbanilide-2',3',5',6'-d4; 3-(4-Chlorophenyl-2,3,5,6-d4)-1-(3,4-dichlorophenyl)urea; Triclocarban (4-chlorophenyl-D4)
    • CS-0227311
    • MS-24726
    • HY-B1805S
    • F93306
    • 1-(4-chloro-2,3,5,6-tetradeuteriophenyl)-3-(3,4-dichlorophenyl)urea
    • Triclocarban-d4
    • 1219799-29-7
    • Inchi: 1S/C13H9Cl3N2O/c14-8-1-3-9(4-2-8)17-13(19)18-10-5-6-11(15)12(16)7-10/h1-7H,(H2,17,18,19)
    • InChI Key: ICUTUKXCWQYESQ-UHFFFAOYSA-N
    • SMILES: N(C1C=CC(Cl)=C(Cl)C=1)C(=O)NC1C([H])=C([H])C(Cl)=C([H])C=1[H]

Computed Properties

  • Exact Mass: 318.003153g/mol
  • Monoisotopic Mass: 318.003153g/mol
  • Isotope Atom Count: 4
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 2
  • Complexity: 308
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 5.3
  • Topological Polar Surface Area: 41.1?2

Triclocarban-d4 (4-chlorophenyl-d4) Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
T774201-0.5mg
Triclocarban-d4 (4-chlorophenyl-d4)
1219799-29-7
0.5mg
$ 55.00 2023-03-31
TRC
T774201-1mg
Triclocarban-d4 (4-chlorophenyl-d4)
1219799-29-7
1mg
$ 88.00 2023-09-05
TRC
T774201-5mg
Triclocarban-d4 (4-chlorophenyl-d4)
1219799-29-7
5mg
$ 178.00 2023-09-05
MedChemExpress
HY-B1805S-1mg
Triclocarban-d
1219799-29-7 ≥98.0%
1mg
¥830 2024-04-20
MedChemExpress
HY-B1805S-5mg
Triclocarban-d
1219799-29-7 ≥98.0%
5mg
¥2800 2024-04-20
MedChemExpress
HY-B1805S-10mg
Triclocarban-d
1219799-29-7 ≥98.0%
10mg
¥4500 2024-04-20
TRC
T774201-.5mg
Triclocarban-d4 (4-chlorophenyl-d4)
1219799-29-7
5mg
$64.00 2023-05-17
SHENG KE LU SI SHENG WU JI SHU
sc-506150-10 mg
Triclocarban-d4 (4-chlorophenyl-d4),
1219799-29-7
10mg
¥1,354.00 2023-07-11
SHENG KE LU SI SHENG WU JI SHU
sc-506150-10mg
Triclocarban-d4 (4-chlorophenyl-d4),
1219799-29-7
10mg
¥1354.00 2023-09-05
A2B Chem LLC
AY10448-1mg
Triclocarban-d4 (4-chlorophenyl-d4)
1219799-29-7 98%
1mg
$118.00 2024-04-20

Triclocarban-d4 (4-chlorophenyl-d4) Suppliers

Tiancheng Chemical (Jiangsu) Co., Ltd
Gold Member
Audited Supplier Audited Supplier
(CAS:1219799-29-7)Triclocarban-d4 (4-chlorophenyl-d4)
Order Number:LE16391
Stock Status:in Stock
Quantity:25KG,200KG,1000KG
Purity:99%
Pricing Information Last Updated:Friday, 20 June 2025 12:14
Price ($):discuss personally

Triclocarban-d4 (4-chlorophenyl-d4) Related Literature

Additional information on Triclocarban-d4 (4-chlorophenyl-d4)

Introduction to Triclocarban-d4 (4-chlorophenyl-d4): CAS No. 1219799-29-7

Triclocarban-d4 (4-chlorophenyl-d4), with the CAS number 1219799-29-7, is a deuterated analog of triclocarban, a widely studied compound in the field of environmental and biomedical research. This compound is particularly valuable for its stable isotope labeling, which facilitates detailed studies in various scientific disciplines, including pharmacology, toxicology, and environmental science.

The chemical structure of Triclocarban-d4 (4-chlorophenyl-d4) is characterized by the presence of four deuterium atoms on the phenyl ring, which replaces the hydrogen atoms. This deuterium substitution provides enhanced stability and distinct spectral properties, making it an ideal candidate for high-resolution analytical techniques such as mass spectrometry and nuclear magnetic resonance (NMR) spectroscopy.

In recent years, the use of deuterated compounds like Triclocarban-d4 (4-chlorophenyl-d4) has gained significant attention due to their applications in tracing studies and metabolic profiling. Deuterium-labeled compounds are often used to track the fate and behavior of molecules in complex biological systems, providing insights into their metabolism, distribution, and potential interactions with other biomolecules.

One of the key areas where Triclocarban-d4 (4-chlorophenyl-d4) has been extensively studied is in environmental monitoring. Triclocarban, a common antimicrobial agent found in personal care products, has been detected in various environmental matrices such as water, soil, and sediments. The deuterated form of triclocarban allows researchers to differentiate between natural and anthropogenic sources of this compound, thereby aiding in the assessment of environmental contamination and the effectiveness of remediation strategies.

In the realm of pharmacology and toxicology, Triclocarban-d4 (4-chlorophenyl-d4) serves as a valuable tool for understanding the pharmacokinetics and toxicodynamics of triclocarban. Studies have shown that triclocarban can exhibit endocrine-disrupting properties and may have adverse effects on aquatic organisms. By using deuterated triclocarban, researchers can more accurately measure its bioaccumulation and biotransformation processes in living organisms.

The stability and distinct isotopic signature of Triclocarban-d4 (4-chlorophenyl-d4) also make it suitable for use in clinical research. In clinical trials, deuterated compounds are often employed to monitor drug metabolism and evaluate the efficacy and safety of new therapeutic agents. The ability to track these compounds with high precision enhances the reliability of clinical data and supports the development of more effective treatments.

Beyond its applications in research, Triclocarban-d4 (4-chlorophenyl-d4) has potential implications for regulatory science. Regulatory agencies often require detailed information on the environmental fate and health effects of chemicals used in consumer products. Deuterated analogs like triclocarban can provide crucial data to inform risk assessments and guide policy decisions.

In conclusion, Triclocarban-d4 (4-chlorophenyl-d4), CAS No. 1219799-29-7, is a versatile compound with a wide range of applications in scientific research. Its unique properties make it an indispensable tool for advancing our understanding of environmental contamination, drug metabolism, and toxicological effects. As research continues to evolve, the importance of deuterated compounds like triclocarban will likely grow, contributing to more informed decision-making in both scientific and regulatory contexts.

Recommended suppliers
Tiancheng Chemical (Jiangsu) Co., Ltd
(CAS:1219799-29-7)Triclocarban-d4 (4-chlorophenyl-d4)
LE16391
Purity:99%
Quantity:25KG,200KG,1000KG
Price ($):Inquiry
Email