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CAS Number: 35970-79-7
4-chloro-6-phenylthieno[2,3-d]pyrimidine

Structure

 4-chloro-6-phenylthieno[2,3-d]pyrimidine
Name: 4-chloro-6-phenylthieno[2,3-d]pyrimidine
Synonyms:
General Information
Product Number: 35970797

CAS Registry Number 35970-79-7
Name:
Thieno[2,?3-?d]?pyrimidine, 4-?chloro-?6-?phenyl-
4-Chloro-6-phenylthieno[2,3-d]pyrimidine

 

Chemical Formula: C12H7ClN2S
Exact Mass: 246.00
Molecular Weight: 246.72
m/z: 246.00 (100.0%), 248.00 (36.7%), 247.01 (13.1%), 249.00 (5.2%), 247.00 (1.5%), 249.99 (1.4%)

 

InChI:InChI=1S/C12H7ClN2S/c13-11-9-6-10(8-4-2-1-3-5-8)16-12(9)15-7-14-11/h1-7H

InChI Key:WJFATWIQZZNARY-UHFFFAOYSA-N

Canonical SMILES:C1=CC=C(C=C1)C2=CC3=C(S2)N=CN=C3Cl

 

Thermal Properties Value Condition Note
Melting Point 143-145 °C Solv: ligroine (8032-32-4); ethyl acetate (141-78-6) (1)CAS
Melting Point 138-141 °C Solv: hexane (110-54-3) (1)CAS

Specification

98%
References
  1. (1) Therkelsen, Frans D.; Organic Letters 2004, V6(12), P1991-1994 CAPLUS
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