1,3-Diphenylthiourea | CAS No. 102-08-9

Q: What is 1,3-Diphenylthiourea (CAS: 102-08-9)?

1,3-Diphenylthiourea is an organic compound with the chemical formula C14H12N2S. It is a white crystalline solid with a faint odor, commonly used as a reagent in chemical synthesis. This compound is known for its ability to form coordination complexes and is characterized by its thiourea functional group, which makes it useful in various chemical reactions involving sulfur and nitrogen.

Q: What are the main uses of 1,3-Diphenylthiourea (CAS: 102-08-9)?

1,3-Diphenylthiourea is primarily used in pharmaceutical research as a building block for drug development. It also finds applications in the synthesis of heterocyclic compounds and as a ligand in coordination chemistry. Additionally, it is used in industrial processes for modifying materials and in organic synthesis for creating functionalized derivatives.

Q: Is 1,3-Diphenylthiourea (CAS: 102-08-9) safe?

1,3-Diphenylthiourea is generally considered safe when handled properly, but it should be treated with caution. It is classified as a potential irritant to skin and eyes, and inhalation may cause respiratory irritation. Safety standards recommend using appropriate personal protective equipment (PPE) and working in a well-ventilated area to minimize exposure and ensure safe handling.

Q: How should 1,3-Diphenylthiourea (CAS: 102-08-9) be stored?

1,3-Diphenylthiourea should be stored in a cool, dry, and dark place to maintain its stability. It is best kept in a sealed container away from moisture and air to prevent degradation. Storage at temperatures below 25°C is recommended, and it should be protected from light to avoid any chemical changes or loss of potency.

1,3-Diphenylthiourea

Basic Information

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CAS Number

102-08-9

Molecular Formula

C13H12N2S

Molecular Weight

228.32 g/mol

Chemical Classification

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

150.0 to 153.0 deg-C

Boiling Point

50℃

Water Solubility

<0.01 g/100 mL at 19 ºC

Flash Point

164.7°C

Refractive Index

1.5700 (estimate)

SMILES

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S=C(Nc1ccccc1)Nc2ccccc2

InChI

InChI=1S/C13H12N2S/c16-13(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h1-10H,(H2,14,15,16)

InChIKey

FCSHMCFRCYZTRQ-UHFFFAOYSA-N

LogP

3.4955000000000016

Topological Polar Surface Area

24.06 Å²

Hydrogen Bond Donor/Acceptor

2 / 2

Complexity

196

Safety Information

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GHS Hazard Pictograms

H300

Hazard Statement

H300 Fatal if swallowed
Acute toxicity, oral

Hazard Class

Class 6.1 Class 6.1

Stability

Stable. Combustible. Incompatible with strong oxidizing agents.

Toxicity

MLD orally in rabbits: 1.5 g/kg (Hanzlik, Irvine)

Synonyms & References

English

Thiocarbanilide
sym-Diphenylthiourea
N,N-Diphenylthiourea (sym.)
1,3-Diphenylthiourea DPTU
N,N-Diphenylthiourea
N,N'Diphenylthiourea
1,2-Diphenyl-2-thiourea
1,3-Difenylthiomocovina
1,3-diphenyl-2-thio-ure
2-Fenylotiomocznik
N,N'-Diphenylthiourea
1,3-Diphenyl-2-thiourea
s-Diphenylthiourea
1,3-diphenylthiourea
N,N′-Diphenylthiourea
N,N′-Diphenylthiourea ,CP
DFT
DPTU
Activit
noccelerc
Anchoracel
usafek-245
vulkacitca
rhenocureca
Nocceler C
USAF ek-245
Diphenylthiourea
Sulfocarbanilide
Thiourea, N,N'-diphenyl-
Stabilisator C
Rhenocure CA

MDL Number

MFCD00004921

Customs Code

2930909090

FAQ

What is 1,3-Diphenylthiourea (CAS: 102-08-9)?

1,3-Diphenylthiourea is an organic compound with the chemical formula C14H12N2S. It is a white crystalline solid with a faint odor, commonly used as a reagent in chemical synthesis. This compound is known for its ability to form coordination complexes and is characterized by its thiourea functional group, which makes it useful in various chemical reactions involving sulfur and nitrogen.

What are the main uses of 1,3-Diphenylthiourea (CAS: 102-08-9)?

1,3-Diphenylthiourea is primarily used in pharmaceutical research as a building block for drug development. It also finds applications in the synthesis of heterocyclic compounds and as a ligand in coordination chemistry. Additionally, it is used in industrial processes for modifying materials and in organic synthesis for creating functionalized derivatives.

Is 1,3-Diphenylthiourea (CAS: 102-08-9) safe?

1,3-Diphenylthiourea is generally considered safe when handled properly, but it should be treated with caution. It is classified as a potential irritant to skin and eyes, and inhalation may cause respiratory irritation. Safety standards recommend using appropriate personal protective equipment (PPE) and working in a well-ventilated area to minimize exposure and ensure safe handling.

How should 1,3-Diphenylthiourea (CAS: 102-08-9) be stored?

1,3-Diphenylthiourea should be stored in a cool, dry, and dark place to maintain its stability. It is best kept in a sealed container away from moisture and air to prevent degradation. Storage at temperatures below 25°C is recommended, and it should be protected from light to avoid any chemical changes or loss of potency.