o-Benzyl-n,n'-diisopropylisourea

Basic Information

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CAS Number

2978-10-1

Molecular Formula

C14H22N2O

Molecular Weight

234.34 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Boiling Point

105°C/1.1mmHg

Density

0.9660

Flash Point

185.9±22.1 °C

Refractive Index

1.4980-1.5020

Vapor Pressure

0.0±0.9 mmHg at 25°C

SMILES

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CC(C)NC(=NC(C)C)OCC1=CC=CC=C1

InChI

InChI=1S/C14H22N2O/c1-11(2)15-14(16-12(3)4)17-10-13-8-6-5-7-9-13/h5-9,11-12H,10H2,1-4H3,(H,15,16)

InChIKey

HTJDVAQGUYGUON-UHFFFAOYSA-N

LogP

2.965600000000001

Topological Polar Surface Area

33.62 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

230

Synonyms & References

English

Carbamimidic acid, N,N'-bis(1-methylethyl)-, phenylmethyl ester
O-Benzyl-N,N'-diisopropylisourea
1,3-diisopropyl-2-benzylisourea
2-benzyl-1,3-diisopropyl isourea
N,N'-diisopropyl-0-benzyl-isourea
N,N'-diisopropyl-o-benzylisourea
O-benzyl-N,N-diisopropylurea
Benzyl N,N'-Diisopropylcarbamimidate
N,N'-Diisopropylcarbamimidic Acid Benzyl Ester
o-benzyl-n,n'-diisopropylisourea
2978-10-1
B4480
CAA97810
BS-44682
SCHEMBL3707807
HTJDVAQGUYGUON-UHFFFAOYSA-N
benzyl N,N'-di(propan-2-yl)carbamimidate
CS-0188279
N,N'-diisopropyl-O-benzylisourea
F16674

MDL Number

MFCD28386087

FAQ

What is o-Benzyl-n,n'-diisopropylisourea (CAS: 2978-10-1)?

o-Benzyl-n,n'-diisopropylisourea (CAS: 2978-10-1) is an organic compound with the structure [C6H5CH2-N(iPr)-N(iPr)-C(O)-N(iPr)], where iPr stands for isopropyl groups. It is a colorless, clear liquid with a molecular weight of approximately 266.35 g/mol. This compound is known for its high boiling point and low volatility, making it suitable for various applications.

What are the main uses of o-Benzyl-n,n'-diisopropylisourea (CAS: 2978-10-1)?

o-Benzyl-n,n'-diisopropylisourea (CAS: 2978-10-1) is primarily used in the pharmaceutical industry as an intermediate for the synthesis of medicinal compounds. It is also utilized in the research field for studying certain biological and chemical reactions, and in some industrial applications for its specific chemical properties.

Is o-Benzyl-n,n'-diisopropylisourea (CAS: 2978-10-1) safe?

o-Benzyl-n,n'-diisopropylisourea (CAS: 2978-10-1) is generally considered safe when handled with appropriate precautions. It is important to avoid skin contact and inhalation. Protective measures include wearing gloves and a lab coat, and working in a well-ventilated area. Spills should be cleaned up immediately and disposed of according to local regulations.

How should o-Benzyl-n,n'-diisopropylisourea (CAS: 2978-10-1) be stored?

o-Benzyl-n,n'-diisopropylisourea (CAS: 2978-10-1) should be stored in a cool, dry place away from direct sunlight and heat sources. It is best kept in a tightly sealed container to prevent degradation. The storage temperature should be maintained below 30°C (86°F) to ensure stability. Humidity should be kept as low as possible to prevent moisture absorption, which could affect its chemical properties.