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CAS Number: 69696-37-3
5-bromo-2,4-dimethylpyrimidine

Structure

5-bromo-2,4-dimethylpyrimidine
Name: 5-bromo-2,4-dimethylpyrimidine
Synonyms:
General Information
Product Number: 69696373
CAS Registry Number: 69696-37-3
Name:
        Pyrimidine, 5-​bromo-​2,​4-​dimethyl-
        5-​Bromo-​2,​4-​dimethylpyrimidine 
 
Chemical Formula: C6H7BrN2
Exact Mass: 185.98
Molecular Weight: 187.04
m/z: 185.98 (100.0%), 187.98 (97.3%), 186.98 (7.2%), 188.98 (6.4%)
Elemental Analysis: C, 38.53; H, 3.77; Br, 42.72; N, 14.98
 
InChI: InChI=1S/C6H7BrN2/c1-4-6(7)3-8-5(2)9-4/h3H,1-2H3
InChIKey: UITPCPFEEVHRRJ-UHFFFAOYSA-N
Canonical SMILES : CC1=NC(=NC=C1Br)C
 
Thermal Properties Value Condition Note
Boiling Point 78-81 °C Press: 18 Torr (1)IC
Melting Point 136-137 °C   (2)CAS
Melting Point 41-42 °C   (1)IC
Melting Point 41-42 °C   (3)IC

Specification

98%

References
  1. (1) Edo, Kiyoto; Chemical & Pharmaceutical Bulletin 1978, V26(12), P3843-50 CAPLUS
  2. (2) Ochiai, Eiji; Yakugaku Zasshi 1937, V57, P579-87(in German 109-12) CAPLUS
  3. (3) Sakamoto, Takao; Synthesis 1984, (3), P252-4 CAPLUS
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