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CAS Number: 13036-57-2
2-chloro-4-methylpyrimidine

Structure

2-chloro-4-methylpyrimidine
Name: 2-chloro-4-methylpyrimidine
Synonyms:
General Information
Product Number: 13036572

CAS Registry Number 13036-57-2
Name:
Pyrimidine, 2-?chloro-?4-?methyl-
2-Chloro-4-methylpyrimidine

 

Chemical Formula: C5H5ClN2
Exact Mass: 128.01
Molecular Weight: 128.56
m/z: 128.01 (100.0%), 130.01 (32.0%), 129.02 (5.5%), 131.01 (2.0%)

 

InChI:InChI=1S/C5H5ClN2/c1-4-2-3-7-5(6)8-4/h2-3H,1H3

InChI Key:BHAKRVSCGILCEW-UHFFFAOYSA-N

Canonical SMILES:CC1=NC(=NC=C1)Cl

 

Thermal Properties Value Condition Note
Boiling Point 101 °C Press: 23 Torr (1)CAS
Boiling Point 101 °C Press: 23 Torr (2)CAS
Boiling Point 93.0-93.5 °C Press: 17 Torr (3)CAS
Boiling Point 75-79 °C Press: 11 Torr (4)CAS
Boiling Point 65 °C Press: 0.01 Torr (5)IC
Melting Point 48-50 °C   (3)CAS
Melting Point 48 °C   (1)CAS

Specification

98%

References
  1. (1) Matsukawa, Taizo; Yakugaku Zasshi 1949, V69, P489-91 CAPLUS
  2. (2) Matsukawa, Taizo; Yakugaku Zasshi 1950, V70, P134-7 CAPLUS
  3. (3) Marshall, J. R.; Journal of the Chemical Society 1951, P1004-17 CAPLUS
  4. (4) Seefelder, Matthias; GB 913910 1962 CAPLUS
  5. (5) Harden, Donald B.; Journal of Organic Chemistry 1988, V53(17), P4137-40 CAPLUS
  6. (7) Ehsan, M.; Pakistan Journal of Scientific and Industrial Research 1989, V32(6), P377-9 CAPLUS
  7. (8) Busby, Reginald E.; Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999) 1979, (11), P2786-8 CAPLUS
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