Cacodylic acid - ≥98% , CAS No.75-60-5

CAS: 75-60-5 Cat. No.: C109768 Molecular Weight: 138 EC Number: 200-883-4

GRADE & PURITY ≥98%

Synonyms

CACODYLIC ACID [MI] | Dimethylarsonic Acid | Acide cacodylique | Arsinic acid, dimethyl- | Bolls | BRN 1736965 | Cacodylate | Lithium, [(dimethyloxoarsenio)oxy]- | Sylvicor | Acide dimethylarsinique [French] | Hydroxydimethylarsine oxide | Acide cacodyliq

Storage

Room temperature,Argon charged

Shipped In

FedEx DG Service

Specifications

Synonyms

CACODYLIC ACID [MI] | Dimethylarsonic Acid | Acide cacodylique | Arsinic acid, dimethyl- | Bolls | BRN 1736965 | Cacodylate | Lithium, [(dimethyloxoarsenio)oxy]- | Sylvicor | Acide dimethylarsinique [French] | Hydroxydimethylarsine oxide | Acide cacodyliq

Specifications & Purity

≥98%

Storage

Room temperature, Argon charged

Shipped In

FedEx DG Service

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 504750574
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504750574
• Canonical Smiles: C[As](=O)(C)O
• IUPAC Name: dimethylarsinic acid
• InChIKey: OGGXGZAMXPVRFZ-UHFFFAOYSA-N
• INCHI: 1S/C2H7AsO2/c1-3(2,4)5/h1-2H3,(H,4,5)
• Isomeric SMILES: C[As](=O)(C)O
• UN Number: 1572
• Packing Group: II
• Molecular Weight: 138
• Reaxy-Rn: 1736965
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1736965&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organometallic compounds
    • Class Organometalloid compounds
      • Subclass Organoarsenic compounds
        • Level5 Pentavalent organic arsenic compounds
          • Level6 Pentaorganoarsanes

• Kingdom: Organic compounds
• Superclass: Organometallic compounds
• Class: Organometalloid compounds
• Subclass: Organoarsenic compounds
• Intermediate Tree Nodes: Pentavalent organic arsenic compounds
• Direct Parent: Pentaorganoarsanes
• Alternative Parents: Organic metalloid salts Alkylarsine oxides Organopnictogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Pentaorganoarsane - Alkylarsine oxide - Oxygen-containing organoarsenic compound - Organic metalloid salt - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as pentaorganoarsanes. These are organoarsenic compounds containing an arsenic compound that is pentasubstituted by only organic groups.
• External Descriptors: Arsenical herbicides

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Associated Targets(Human)

A498 (42825 Activities)

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ACHN (49357 Activities)

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CAKI-1 (44928 Activities)

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COLO 205 (50209 Activities)

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DU-145 (51482 Activities)

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HL-60 (67320 Activities)

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HT-29 (80576 Activities)

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K562 (73714 Activities)

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KM12 (47707 Activities)

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M14 (47487 Activities)

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MCF7 (126967 Activities)

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MOLT-4 (49676 Activities)

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OVCAR-3 (48710 Activities)

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OVCAR-5 (45555 Activities)

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OVCAR-8 (47708 Activities)

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PC-3 (62116 Activities)

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RPMI-8226 (44974 Activities)

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RXF 393 (41971 Activities)

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SF-295 (48000 Activities)

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SK-MEL-2 (46422 Activities)

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SK-MEL-28 (48833 Activities)

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SK-MEL-5 (47095 Activities)

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SK-OV-3 (52876 Activities)

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SN12C (47755 Activities)

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SNB-19 (46794 Activities)

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TK-10 (45540 Activities)

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U-251 (51189 Activities)

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UACC-257 (46019 Activities)

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UACC-62 (47335 Activities)

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UO-31 (46270 Activities)

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786-0 (47912 Activities)

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A549 (127892 Activities)

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NCI/ADR-RES (33767 Activities)

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T47D (39041 Activities)

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EKVX (44102 Activities)

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NCI-H322M (45589 Activities)

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HCT-116 (91556 Activities)

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HOP-92 (41141 Activities)

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Hs-578T (29457 Activities)

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NCI-H460 (60772 Activities)

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SF-268 (49410 Activities)

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IGROV-1 (47897 Activities)

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LOX IMVI (44321 Activities)

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HOP-62 (47048 Activities)

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MDA-MB-435 (38290 Activities)

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MDA-N (28205 Activities)

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Malme-3M (44254 Activities)

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MDA-MB-231 (73002 Activities)

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SNB-75 (44215 Activities)

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NCI-H23 (49055 Activities)

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Associated Targets(non-human)

GCN5 Histone acetyltransferase GCN5 (89 Activities)

Discover Target: GCN5

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Mechanisms of Action

Chemical and Physical Properties

• Sensitivity: Hygroscopic
• Melt Point(°C): 192-198°C
• Molecular Weight: 138.000 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 137.966 Da
• Monoisotopic Mass: 137.966 Da
• Topological Polar Surface Area: 37.300 Ų
• Heavy Atom Count: 5
• Formal Charge: 0
• Complexity: 62.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

XLogP3

References

1. Ma Xiao-Yan, Xie Qing-Qing, Hadiya Ablat, Xamsiya Nurmamat, Zhao Zhi-Xi.  (2023)  Preparation of magnetic composites and their dimethyl arsonic acid adsorption performances.  ENVIRONMENTAL SCIENCE AND POLLUTION RESEARCH,  30  (21): (59554-59566).  [PMID:37010680] [10.1007/s11356-023-26770-3]

2. Guangbin Zhu, Ning Duan, Linhua Jiang, Fuyuan Xu, Hongping He, Wen Cheng, Rong Zhang, Yong Liu, Yanli Xu, Shaige Xia, Xiaolu Sun, Fawei Lin.  (2024)  Direct determination of high-concentration As(III) by UV high-reference differential absorption spectroscopy for cleaner As(III) removal promotion via sulfurization.  SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY,      [PMID:38237501] [10.1016/j.saa.2024.123884]