3-Methyl-1,1-diphenylurea

Basic Information

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CAS Number

13114-72-2

Molecular Formula

C14H14N2O

Molecular Weight

226.28 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

172-174 °C

Boiling Point

367.89°C (rough estimate)

Refractive Index

1.6419 (estimate)

SMILES

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CNC(=O)N(C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChI=1S/C14H14N2O/c1-15-14(17)16(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11H,1H3,(H,15,17)

InChIKey

IMFYAZJNDOZIFV-UHFFFAOYSA-N

LogP

3.1641000000000012

Topological Polar Surface Area

32.34 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

225

Safety Information

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GHS Hazard Pictograms

H319

Hazard Statement

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

Urea, methyldiphenyl-
MLS000038862
HMS2159J05
UREA, 3-METHYL-1,1-DIPHENYL-
CBDivE_000396
3-Methyl-1,1-diphenylurea, >=95.0%
CHEMBL1386499
Urea, N'-methyl-N,N-diphenyl-
SCHEMBL264029
CCRIS 6059
CAS-13114-72-2
3-methyl-1,1-diphenyl-urea
UNII-NR12XN9HWN
DTXCID405593
FT-0608058
N-methyl-N',N'-diphenylurea
Akardite II
1,1-Diphenyl-3-methylurea
Temozolomide Related Compound B; 3-Methyl-1,1-diphenylurea; Temozolomide Related Compound B
13114-72-2
cid_25711
MLS002415759
EINECS 236-039-7
CS-W004643
NCGC00066037-02
AKARDIT II
IDI1_032435
HMS1528E05
ACARDITE II
BRD-K16324026-001-01-9
3-Methyl-d3-1,1-diphenylurea

MDL Number

MFCD00043722

Customs Code

2924299090

FAQ

What is 3-Methyl-1,1-diphenylurea (CAS: 13114-72-2)?

3-Methyl-1,1-diphenylurea (CAS: 13114-72-2) is an organic compound with the molecular formula C15H14N2. It is a solid with a faint aromatic odor. It is used in research and pharmaceuticals as a starting material for the synthesis of other compounds.

What are the main uses of 3-Methyl-1,1-diphenylurea (CAS: 13114-72-2)?

3-Methyl-1,1-diphenylurea (CAS: 13114-72-2) is primarily used as a precursor in organic synthesis, particularly in the development of pharmaceuticals. It is also used in research for its potential medicinal applications.

Is 3-Methyl-1,1-diphenylurea (CAS: 13114-72-2) safe?

3-Methyl-1,1-diphenylurea (CAS: 13114-72-2) is moderately safe but requires handling with care due to its potential to irritate the skin and eyes. Protective gloves and goggles should be worn during handling. It is essential to store it in a well-ventilated area and avoid contact with open flames or heat sources.

How should 3-Methyl-1,1-diphenylurea (CAS: 13114-72-2) be stored?

3-Methyl-1,1-diphenylurea (CAS: 13114-72-2) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a sealed container to prevent degradation and contamination. It is important to store it in a well-ventilated area to avoid inhaling the fumes.