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CAS Number: 13036-50-5
2-chloro-4-phenylpyrimidine

Structure

 2-chloro-4-phenylpyrimidine
Name: 2-chloro-4-phenylpyrimidine
Synonyms:
General Information
Product Number: 13036505

CAS Registry Number 13036-50-5
Name:
Pyrimidine, 2-?chloro-?4-?phenyl-
2-Chloro-4-phenylpyrimidine
2-Chloro-6-phenylpyrimidine

 

Chemical Formula: C10H7ClN2
Exact Mass: 190.03
Molecular Weight: 190.63
m/z: 190.03 (100.0%), 192.03 (32.0%), 191.03 (11.6%), 193.03 (3.5%)

 

InChI:InChI=1S/C10H7ClN2/c11-10-12-7-6-9(13-10)8-4-2-1-3-5-8/h1-7H

InChI Key:AAZYJKNISGEWEV-UHFFFAOYSA-N

Canonical SMILES:C1=CC=C(C=C1)C2=NC(=NC=C2)Cl

 

Thermal Properties Value Condition Note
Melting Point 109.5-111.5 °C   (7)CAS
Melting Point 87-89 °C   (8)CAS
Melting Point 84-86 °C   (1)CAS
Melting Point 84-86 °C Solv: hexane (110-54-3); toluene (108-88-3) (9)IC

Specification

98%
References
  1. (1) Guchhait, Sankar K.; Synthesis 2010, (7), P1166-1170 CAPLUS
  2. (7) Anderson, Samantha C.; Synthesis 2010, (16), P2721-2724 CAPLUS
  3. (8) Matsukawa, Taizo; Yakugaku Zasshi 1950, V70, P134-7 CAPLUS
  4. (9) Harden, Donald B.; Journal of Organic Chemistry 1988, V53(17), P4137-40 CAPLUS
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