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CAS Number: 28900-10-9
2-chloro-6-methylnicotinonitrile

Structure

2-chloro-6-methylnicotinonitrile
Name: 2-chloro-6-methylnicotinonitrile
Synonyms:
General Information
Product Number: 28900109

CAS Registry Number 28900-10-9
Name:
3-?Pyridinecarbonitrile?, 2-?chloro-?6-?methyl-
Nicotinonitrile, 2-chloro-6-methyl- (8CI)
2-Chloro-6-methyl-3-pyridinecarbonitrile
2-Chloro-3-cyano-6-methylpyridine
2-Chloro-6-methylnicotinonitrile

 

Chemical Formula: C7H5ClN2
Exact Mass: 152.01
Molecular Weight: 152.58
m/z: 152.01 (100.0%), 154.01 (32.0%), 153.02 (7.6%), 155.01 (2.7%)

 

InChI:InChI=1S/C7H5ClN2/c1-5-2-3-6(4-9)7(8)10-5/h2-3H,1H3

InChI Key:YSBNBAYNISAUIT-UHFFFAOYSA-N

Canonical SMILES:CC1=NC(=C(C=C1)C#N)Cl

 

Thermal Properties Value Condition Note
Boiling Point 140-145 °C Press: 1 Torr (1)CAS
Melting Point 117 °C Solv: methanol (67-56-1) (1)CAS
Melting Point 114.5-115.5 °C   (6)CAS
Melting Point 114-116 °C   (7)CAS
Melting Point 114-115 °C   (8)CAS
Melting Point 114-115 °C Solv: ligroine (8032-32-4) (4)IC
Melting Point 114 °C Solv: benzene (71-43-2) (5)IC
Melting Point 85 °C Solv: water (7732-18-5); ethanol (64-17-5) (9)IC

Specification

98%

References
  1. (1) Lespagnol, Albert; Bulletin de la Societe de Pharmacie de Lille 1955, (No. 1), P60-2 CAPLUS
  2. (4) Hassan, M. A.; Polish Journal of Chemistry 1982, V56(2), P419-23 CAPLUS
  3. (5) Hassan, M. A.; Revue Roumaine de Chimie 1982, V27(8), P963-7 CAPLUS
  4. (6) Reider, Malcolm J.; Journal of Organic Chemistry 1942, V7, P286-96 CAPLUS
  5. (7) Becker, Irwin; Journal of Heterocyclic Chemistry 2008, V45(4), P1005-1022 CAPLUS
  6. (8) Perez-Medina, L. A.; Journal of the American Chemical Society 1947, V69, P2574-9 CAPLUS
  7. (9) Weglinski, Zbigniew; Roczniki Chemii 1977, V51(12), P2401-9 CAPLUS
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