Product Name

  • Name

    TRICHOSTATIN A

  • EINECS 611-758-2
  • CAS No. 58880-19-6
  • Article Data7
  • CAS DataBase
  • Density 1.139 g/cm3
  • Solubility Soluble in ethanol: 1 mg/mL
  • Melting Point 141°C -143°C
  • Formula C17H22N2O3
  • Boiling Point
  • Molecular Weight 302.373
  • Flash Point
  • Transport Information
  • Appearance Off-white powder
  • Safety 26-36
  • Risk Codes 20/21/22-36/37/38-43
  • Molecular Structure Molecular Structure of 58880-19-6 (TRICHOSTATIN A)
  • Hazard Symbols HarmfulXn
  • Synonyms 2,4-Heptadienamide,7-[4-(dimethylamino)phenyl]-N-hydroxy-4,6-dimethyl-7-oxo-, [R-(E,E)]-;(R)-Trichostatin A;TSA;Trichostatin A;
  • PSA 69.64000
  • LogP 2.97020

Trichostatin A Specification

This chemical is called 2,4-Heptadienamide,7-[4-(dimethylamino)phenyl]-N-hydroxy-4,6-dimethyl-7-oxo-, (2E,4E,6R)-, and its systematic name is (2E,4E,6R)-7-[4-(dimethylamino)phenyl]-N-hydroxy-4,6-dimethyl-7-oxohepta-2,4-dienamide. With the CAS registry number of 58880-19-6, its classification codes are Anti-Infective Agents; Antibiotics, Antifungal; Antifungal Agents; Enzyme Inhibitors; Histone Deacetylase Inhibitors; Mutation Data; Protein Synthesis Inhibitors. Additionally, it should be stored at the temperature of −20 °C.

Other characteristics of the 2,4-Heptadienamide,7-[4-(dimethylamino)phenyl]-N-hydroxy-4,6-dimethyl-7-oxo-, (2E,4E,6R)- can be summarised as followings: (1)ACD/LogP: 2.77; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.77; (4)ACD/LogD (pH 7.4): 2.76; (5)ACD/BCF (pH 5.5): 75.05; (6)ACD/BCF (pH 7.4): 72.95; (7)ACD/KOC (pH 5.5): 765.41; (8)ACD/KOC (pH 7.4): 744; (9)#H bond acceptors: 5; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 49.85 Å2; (13)Index of Refraction: 1.578; (14)Molar Refractivity: 88.1 cm3; (15)Molar Volume: 265.3 cm3; (16)Polarizability: 34.92×10-24cm3; (17)Surface Tension: 45.9 dyne/cm; (18)Density: 1.139 g/cm3.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing when you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure: 
1.SMILES: O=C(NO)\C=C\C(=C\[C@H](C(=O)c1ccc(N(C)C)cc1)C)C
2.InChI: InChI=1/C17H22N2O3/c1-12(5-10-16(20)18-22)11-13(2)17(21)14-6-8-15(9-7-14)19(3)4/h5-11,13,22H,1-4H3,(H,18,20)/b10-5+,12-11+/t13-/m1/s1
3. InChIKey: RTKIYFITIVXBLE-QEQCGCAPBF

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