O,O,O-Tris(4-aminophenyl) phosphorothioate

Basic Information

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CAS Number

52664-35-4

Molecular Formula

C18H18N3O3PS

Molecular Weight

387.4 g/mol

Basic Physical Properties

Melting Point

156 ºC

Density

1.421

SMILES

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c1cc(ccc1N)OP(=S)(Oc2ccc(cc2)N)Oc3ccc(cc3)N

InChI

InChI=1S/C18H18N3O3PS/c19-13-1-7-16(8-2-13)22-25(26,23-17-9-3-14(20)4-10-17)24-18-11-5-15(21)6-12-18/h1-12H,19-21H2

InChIKey

MBUAAMOJATXYKR-UHFFFAOYSA-N

LogP

4.1945000000000014

Topological Polar Surface Area

105.75 Å²

Hydrogen Bond Donor/Acceptor

6 / 6

Synonyms & References

English

Phenol, 4-amino-,phosphorothioate (3:1) (ester) (9CI)
Phenol,4-amino-,phosphorothioate(3:1)ester
TRIS-(4-AMINOPHENYL)THIOPHOSPHATE
Tris-(4-aminophenyl)-phosphorothioate
Tris(4-Amino Phenyl)thiophos
Einecs 258-083-6
Thionophosphoric acid- tris-( p-aMinophenyl ester )TPTA
O,O,O-tris(4-aMinophenyl) phosphorothioate
TRIS(4-AMINOPHENYL) THIOPHOSPHATE
Tris-(4-amino-phenyl)-thiophosphat
Tris-(p-aminophenyl)-thiophosphat

MDL Number

MFCD00036100

Customs Code

2922499990

FAQ

What is O,O,O-Tris(4-aminophenyl) phosphorothioate (CAS: 52664-35-4)?

O,O,O-Tris(4-aminophenyl) phosphorothioate (CAS: 52664-35-4) is a chemical compound with a molecular formula of C16H15N3OP2S. It is a colorless to white crystalline solid with a pungent odor. This compound is used in various applications, including pharmaceuticals and research.

What are the main uses of O,O,O-Tris(4-aminophenyl) phosphorothioate (CAS: 52664-35-4)?

O,O,O-Tris(4-aminophenyl) phosphorothioate (CAS: 52664-35-4) is primarily used in pharmaceuticals as an intermediate in the synthesis of various drugs. It is also used in research for its unique chemical properties.

Is O,O,O-Tris(4-aminophenyl) phosphorothioate (CAS: 52664-35-4) safe?

O,O,O-Tris(4-aminophenyl) phosphorothioate (CAS: 52664-35-4) is considered safe when used appropriately. However, it is necessary to take proper safety precautions, such as wearing protective gloves and goggles, to avoid skin and eye contact. It should be stored in a well-ventilated area and kept away from direct sunlight.

How should O,O,O-Tris(4-aminophenyl) phosphorothioate (CAS: 52664-35-4) be stored?

O,O,O-Tris(4-aminophenyl) phosphorothioate (CAS: 52664-35-4) should be stored in a cool, dry place at a temperature below 30°C. It should be kept away from direct sunlight and stored in a tightly sealed container to prevent moisture and contamination.