Benzoyleneurea

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For Research Use Only.

Category

Impurities

Cat.No.

NP2765

CAS

86-96-4

Product Name

Benzoyleneurea

Structure

Description

Benzoyleneurea (CAS# 86-96-4) is a building block used in many fragment-based drug design. Benzouracil is an alkaloid from marine bryozoan.

Synonyms

1H-quinazoline-2,4-dione

IUPAC Name

1H-quinazoline-2,4-dione

Molecular Weight

162.15

Molecular Formula

C8H6N2O2

Canonical SMILES

C1=CC=C2C(=C1)C(=O)NC(=O)N2

InChI

InChI=1S/C8H6N2O2/c11-7-5-3-1-2-4-6(5)9-8(12)10-7/h1-4H,(H2,9,10,11,12)

InChIKey

SDQJTWBNWQABLE-UHFFFAOYSA-N

Boiling Point

491.9 °C at 760 mmHg

Melting Point

300 °C

Purity

98 %

Density

1.336 g/cm³

Solubility

>24.3 [ug/mL] (The mean of the results at pH 7.4)

Appearance

White to light pink fluffy powder

Form

Powder

MDL

MFCD00006699

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