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Benzoyleneurea

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Benzoyleneurea Basic information

Product Name:
Benzoyleneurea
Synonyms:
  • Urea, benzoylene-
  • yT
  • 2,4(1H,3H)-Quinazolinedione, 97+%
  • (1h,3h)quinazolinedione-2,4
  • 2,4-dioxotetrahydroquinazoline
  • 2,4-quinazolinedione
  • 2-keto-4-quinazolinone
  • Benzoyleneurea 97%
CAS:
86-96-4
MF:
C8H6N2O2
MW:
162.15
EINECS:
201-712-6
Product Categories:
  • Quinazolines
  • Building Blocks
  • Chemical Synthesis
  • Heterocyclic Building Blocks
  • Heterocycles
  • bc0001
Mol File:
86-96-4.mol
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Benzoyleneurea Chemical Properties

Melting point:
300 °C(lit.)
Boiling point:
288.82°C (rough estimate)
Density 
1.3264 (rough estimate)
refractive index 
1.5770 (estimate)
storage temp. 
Sealed in dry,Room Temperature
solubility 
ammonium hydroxide: soluble10mg/mL
pka
11.12±0.20(Predicted)
form 
Solid
color 
Off-White to Pale Grey
λmax
217nm(EtOH)(lit.)
BRN 
383776
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
SMILES
O=C1NC(=O)c2ccccc2N1
CAS DataBase Reference
86-96-4(CAS DataBase Reference)
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Safety Information

Safety Statements 
24/25-22
WGK Germany 
2
RTECS 
VA1390000
HS Code 
29242100
Storage Class
11 - Combustible Solids

MSDS

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Benzoyleneurea Usage And Synthesis

Chemical Properties

white to light pink fluffy powder

Uses

Benzoyleneurea scaffold was used in the synthesis of novel protein geranylgeranyltransferase-I inhibitors. It was used to study the mechanism of inactivation of chymotrypsin and other serine proteases by benzoxazinones.

Synthesis Reference(s)

Journal of Heterocyclic Chemistry, 21, p. 5, 1984 DOI: 10.1002/jhet.5570210102
Organic Syntheses, Coll. Vol. 2, p. 79, 1943

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