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CAS Number: 56686-16-9
5-bromo-2,4-dimethoxypyrimidine

Structure

5-bromo-2,4-dimethoxypyrimidine
Name: 5-bromo-2,4-dimethoxypyrimidine
Synonyms:
General Information
Product Number: 56686169

CAS Registry Number 56686-16-9
Name:
Pyrimidine, 5-?bromo-?2,?4-?dimethoxy-
5-Bromo-2,4-dimethoxypyrimidine
2,4-Dimethoxy-5-bromopyrimidine
5-Bromo-2,4-bis(methyloxy)pyrimidine
5-Bromo-2,6-dimethoxypyrimidine
NSC 81442

 

Chemical Formula: C6H7BrN2O2
Exact Mass: 217.97
Molecular Weight: 219.04
m/z: 217.97 (100.0%), 219.97 (97.7%), 218.97 (7.3%), 220.97 (6.5%)

 

InChI:InChI=1S/C6H7BrN2O2/c1-10-5-4(7)3-8-6(9-5)11-2/h3H,1-2H3

InChI Key:QEZIMQMMEGPYTR-UHFFFAOYSA-N

Canonical SMILES:COC1=NC(=NC=C1Br)OC

 

Thermal Properties Value Condition Note
Boiling Point 125 °C Press: 17 Torr (1)CAS
Melting Point 68.0-69.2 °C   (3)CAS
Melting Point 65-66 °C   (6)IC
Melting Point 63-64 °C   (7)CAS
Melting Point 62-64 °C   (4)CAS
Melting Point 51-52 °C   (1)CAS
Melting Point 51-52 °C   (8)IC

Specification

98%

References
  1. (1) Bader, Henry; Journal of Organic Chemistry 1963, V28(8), P2155-7 CAPLUS
  2. (3) Boudet, Nadege; Organic Letters 2008, V10(9), P1715-1718 CAPLUS
  3. (4) Mukherjee, Soumita; Synthetic Communications 2010, V40(13), P1939-1943 CAPLUS
  4. (6) Strekowski, Lucjan; Roczniki Chemii 1974, V48(12), P2157-67 CAPLUS
  5. (7) Hilbert, Guido E.; Journal of the American Chemical Society 1934, V56, P134-9 CAPLUS
  6. (8) Skulski, L.; Khimiya Geterotsiklicheskikh Soedinenii 1989, (2), P249-52 CAPLUS
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