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CAS Number: 88145-89-5
6-bromoquinazoline-2,4(1H,3H)-dione

Structure

6-bromoquinazoline-2,4(1H,3H)-dione
Name: 6-bromoquinazoline-2,4(1H,3H)-dione
Synonyms:
General Information
Product Number: 88145895

CAS Registry Number 88145-89-5
Name:
2,​4(1H,​3H)​-​Quinazolinedione, 6-​bromo-
6-Bromo-1H-quinazoline-2,4-dione
6-Bromo-2,4(1H,3H)-quinazolinedione
6-Bromo-2,4-quinazolinedione
6-Bromoquinazolin-2,4(1H,3H)-dione

 

Chemical Formula: C8H5BrN2O2
Exact Mass: 239.95
Molecular Weight: 241.04
m/z: 239.95 (100.0%), 241.95 (97.3%), 242.95 (9.1%), 240.96 (8.8%)

 

InChI:InChI=1S/C8H5BrN2O2/c9-4-1-2-6-5(3-4)7(12)11-8(13)10-6/h1-3H,(H2,10,11,12,13)

InChI Key:JZDVFUAHGLJVQG-UHFFFAOYSA-N

Canonical SMILES:C1=CC2=C(C=C1Br)C(=O)NC(=O)N2

 

Thermal Properties Value Condition Note
Melting Point 324-326 °C   (7)CAS
Melting Point >300 °C   (2)CAS
Melting Point >300 °C Solv: 1,4-dioxane (123-91-1) (1)CAS
Thermal Properties Value Condition Note
Melting Point 324-326 °C   (7)CAS
Melting Point >300 °C   (2)CAS
Melting Point >300 °C Solv: 1,4-dioxane (123-91-1) (1)CAS

Specification

98%

References
  1. (1) Li, Jiarong; Organic Letters 2009, V11(6), P1193-1196 CAPLUS
  2. (2) Gao, Jian; Tetrahedron 2010, V66(23), P4063-4067 CAPLUS
  3. (7) Kuryazov, R. Sh.; Chemistry of Heterocyclic Compounds (New York, NY, United States) 2010, V46(5), P585-591 CAPLUS
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