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CAS Number: 51752-67-1
4-chloropyrido[3,4-d]pyrimidine

Structure

4-chloropyrido[3,4-d]pyrimidine
Name: 4-chloropyrido[3,4-d]pyrimidine
Synonyms:
General Information
Product Number: 51752671
CAS Registry Number:
51752-67-1
Name:
Pyrido[3,4-d]pyrimidine, 4-chloro-
4-Chloropyrido[3,4-d]pyrimidine 
 
Chemical Formula: C7H4ClN3
Exact Mass: 165.01
Molecular Weight: 165.58
m/z: 165.01 (100.0%), 167.01 (32.0%), 166.01 (8.7%), 168.01 (2.4%)
Elemental Analysis: C, 50.78; H, 2.43; Cl, 21.41; N, 25.38
 
InChI: InChI=1S/C7H4ClN3/c8-7-5-1-2-9-3-6(5)10-4-11-7/h1-4H
InChIKey: UKTHPAHJCQLABU-UHFFFAOYSA-N
Canonical SMILES : C1=CN=CC2=C1C(=NC=N2)Cl
 
 
Thermal Properties Value Condition Note
Melting Point 113 °C   (1)IC
Melting Point 108-110 °C   (2)IC

Specification

98%

References
  1. (1) Nishikawa, Shiro; Agricultural and Biological Chemistry 1986, V50(2), P495-7 CAPLUS
  2. (2) Petric, Andrej; Monatshefte fuer Chemie 1983, V114(5), P615-24 CAPLUS
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