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CAS Number: 5426-59-5
6-bromo-2-methylquinazolin-4(1H)-one

Structure

 6-bromo-2-methylquinazolin-4(1H)-one
Name: 6-bromo-2-methylquinazolin-4(1H)-one
Synonyms:
General Information
Product Number: 5426595

CAS Registry Number 5426-59-5
Name:
4(3H)?-?Quinazolinone, 6-?bromo-?2-?methyl-
4(1H)-Quinazolinone, 6-bromo-2-methyl- (9CI)
4-Quinazolinol, 6-bromo-2-methyl- (7CI)
6-Bromo-2-methyl-1H-quinazolin-4-one
6-Bromo-2-methyl-3,4-dihydroquinazolin-4-one
6-Bromo-2-methyl-3H-quinazolin-4-one

 

Chemical Formula: C9H7BrN2O
Exact Mass: 237.97
Molecular Weight: 239.07
m/z: 237.97 (100.0%), 239.97 (97.4%), 238.98 (9.9%), 240.98 (9.6%)

 

InChI:InChI=1S/C9H7BrN2O/c1-5-11-8-3-2-6(10)4-7(8)9(13)12-5/h2-4H,1H3,(H,11,12,13)

InChI Key:MNYWPPKPTICBPZ-UHFFFAOYSA-N

Canonical SMILES:CC1=NC(=O)C2=C(N1)C=CC(=C2)Br

 

Thermal Properties Value Condition Note
Melting Point 298 °C   (3)CAS
Melting Point 296-298 °C Solv: methanol (67-56-1) (4)IC
Melting Point 294-296 °C   (1)CAS

Specification

98%
References
  1. (1) Zhang, Xiaodong; Green Chemistry 2009, V11(11), P1881-1888 CAPLUS
  2. (3) Hirwe, N. W.; Proceedings - Indian Academy of Sciences, Section A 1941, V13A, P49-52 CAPLUS
  3. (4) Varma, Rajendra S.; Journal of Chemical and Engineering Data 1981, V26(1), P103-4 CAPLUS
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