1,3-Diphenylguanidine

Basic Information

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CAS Number

102-06-7

Molecular Formula

C13H13N3

Molecular Weight

211.27 g/mol

Chemical Classification

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

147.0 to 152.0 deg-C

Boiling Point

170°C

Flash Point

170°C

Solubility

Soluble in alcohol, chloroform, hot benzene, hot toluene, and dilute mineral acids

Refractive Index

1.6000 (estimate)

SMILES

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N=C(Nc1ccccc1)Nc2ccccc2

InChI

InChI=1S/C13H13N3/c14-13(15-11-7-3-1-4-8-11)16-12-9-5-2-6-10-12/h1-10H,(H3,14,15,16)

InChIKey

OWRCNXZUPFZXOS-UHFFFAOYSA-N

LogP

3.1453700000000007

Topological Polar Surface Area

47.910000000000004 Å²

Hydrogen Bond Donor/Acceptor

3 / 3

Complexity

225

Safety Information

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GHS Hazard Pictograms

H302

H315

H319

H335

H411

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

H411 Toxic to aquatic life with long lasting effects
Hazardous to the aquatic environment, long-term hazard

Hazard Class

Class 9 Class 9

Stability

Stable. Combustible. Incompatible with strong oxidizing agents. Moisture sensitive.

Synonyms & References

English

1,3-Diphenylguanidine
DPG
1,3-
N,N-diphenylguanidine (sym.)
Accelerator D
N,N-Diphenylguanidine
Melaniline
Dephenyl Guanidine
sym-diphenylguanidine
n,n'-diphenylguanidine
vanaxdpg
timtec-bbsbb000514
1,3-difenylguanid
1,3-diphenyl-guanidin
akrochemdpg
denax
denaxdpg
dfg
dpg accelerator
dwufenyloguanidyna
dynamine
guanidine, 1,3-diphenyl-
n,n'-diphenyl-guandine
n,n'-diphenyl-guanidin
nci-c60924
Diphenyl guanidine
1.3-Diphenylguanidine
Perkacit? DPG
1,3-diphenyl-guanidine
1N,3N-diphenylguanidine
N,N'-diphenyl-guanidine

MDL Number

MFCD00001758

Customs Code

29252000

FAQ

What is 1,3-Diphenylguanidine (CAS: 102-06-7)?

1,3-Diphenylguanidine (CAS: 102-06-7) is a guanidine derivative with the chemical formula C14H12N4. It appears as a white crystalline solid, known for its low solubility in water and moderate solubility in organic solvents. This compound is characterized by its strong basicity and applications in biochemical research and pharmaceutical development.

What are the main uses of 1,3-Diphenylguanidine (CAS: 102-06-7)?

1,3-Diphenylguanidine (CAS: 102-06-7) is primarily used in pharmaceuticals as a key intermediate in the synthesis of antihypertensive drugs and enzyme inhibitors. It also serves in industrial applications, such as pesticide formulation, and in research for studying molecular interactions. Its unique structure makes it valuable in drug design and chemical studies.

Is 1,3-Diphenylguanidine (CAS: 102-06-7) safe?

1,3-Diphenylguanidine (CAS: 102-06-7) is generally considered safe when handled properly, but it may cause mild skin or eye irritation. Safety data sheets indicate it is not classified as highly toxic, though standard lab precautions like gloves and ventilation are recommended. Always follow OSHA guidelines for chemical handling and storage.

How should 1,3-Diphenylguanidine (CAS: 102-06-7) be stored?

1,3-Diphenylguanidine (CAS: 102-06-7) should be stored in a cool, dry, and dark place, ideally at 25°C (77°F) with low humidity. Keep in a sealed container to prevent moisture exposure, and avoid contact with air or light to maintain stability. Store away from incompatible substances like strong acids.