Product Name

  • Name

    2-(4-METHOXYPHENYLAMINO)-2-THIOXOACETAMIDE

  • EINECS
  • CAS No. 71369-81-8
  • Article Data4
  • CAS DataBase
  • Density 1.355 g/cm3
  • Solubility
  • Melting Point
  • Formula C9H10N2O2S
  • Boiling Point 358.814 °C at 760 mmHg
  • Molecular Weight 210.257
  • Flash Point 170.805 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 71369-81-8 (2-(4-METHOXYPHENYLAMINO)-2-THIOXOACETAMIDE)
  • Hazard Symbols
  • Synonyms Oxamide,N-(p-methoxyphenyl)-1-thio- (7CI);2-[(4-methoxyphenyl)amino]-2-thioxoacetamide;acetamide, 2-[(4-methoxyphenyl)amino]-2-thioxo-;2-[(4-Methoxyphenyl)amino]-2-thioxoacetamide;
  • PSA 96.44000
  • LogP 1.69310

Acetamide,2-[(4-methoxyphenyl)amino]-2-thioxo- Specification

The Acetamide,2-[(4-methoxyphenyl)amino]-2-thioxo-, with the CAS registry number 71369-81-8, has the systematic name of 2-[(4-methoxyphenyl)amino]-2-thioxoacetamide. And the molecular formula of this chemical is C9H10N2O2S. It is a kind of organics, and should be stored in the dry and cool environment.

The physical properties of Acetamide,2-[(4-methoxyphenyl)amino]-2-thioxo- are as following: (1)ACD/LogP: 0.92; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 2; (6)ACD/BCF (pH 7.4): 2; (7)ACD/KOC (pH 5.5): 56; (8)ACD/KOC (pH 7.4): 54; (9)#H bond acceptors: 4; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 96.44 Å2; (13)Index of Refraction: 1.671; (14)Molar Refractivity: 58.028 cm3; (15)Molar Volume: 155.184 cm3; (16)Polarizability: 23.004×10-24cm3; (17)Surface Tension: 66.566 dyne/cm; (18)Density: 1.355 g/cm3; (19)Flash Point: 170.805 °C; (20)Enthalpy of Vaporization: 60.434 kJ/mol; (21)Boiling Point: 358.814 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(N)C(=S)Nc1ccc(OC)cc1
(2)InChI: InChI=1/C9H10N2O2S/c1-13-7-4-2-6(3-5-7)11-9(14)8(10)12/h2-5H,1H3,(H2,10,12)(H,11,14)
(3)InChIKey: FIVODOWKJKUEOQ-UHFFFAOYAH

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