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Home > Encyclopedia > methyl 2-[ethoxy-(propan-2-ylamino)phosphinothioyl]oxybenzoate

methyl 2-[ethoxy-(propan-2-ylamino)phosphinothioyl]oxybenzoate

methyl 2-[ethoxy-(propan-2-ylamino)phosphinothioyl]oxybenzoate structure

methyl 2-[ethoxy-(propan-2-ylamino)phosphinothioyl]oxybenzoate 

structure
  • CAS No:

    101365-44-0

  • Formula:

    C13H20NO4PS

  • Chemical Name:

    methyl 2-[ethoxy-(propan-2-ylamino)phosphinothioyl]oxybenzoate

  • Synonyms:

    Methyl isofenphos; Benzoic acid,2-((ethoxy((1-methylethyl)amino)phosphinothioyl)oxy)-,methyl ester; methyl 2-{[ethoxy(propan-2-ylamino)phosphorothioyl]oxy}benzoate; 1-Methyl 2-((ethoxy((1-methylethyl)amino)phosphinothioyl)-oxy)benzoate;

methyl 2-[ethoxy-(propan-2-ylamino)phosphinothioyl]oxybenzoate Basic Attributes

317.34100

317.08506629 g/mol

Characteristics

98.69000

4.15250

1.197g/cm3

388.3ºC at 760mmHg

188.7ºC

1.536

3.09E-06mmHg at 25°C

Drug Information

1-methyl 2-((ethoxy((1-methylethyl)amino)phosphinothioyl)-oxy)benzoate

Computed Properties

Molecular Weight:317.34
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:317.08506629
Monoisotopic Mass:317.08506629
Topological Polar Surface Area:88.9
Heavy Atom Count:20
Complexity:364
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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