CAS Registry Number: 115093-90-8

Name:

7H-​Pyrrolo[2,​3-​d]​pyrimidine, 4,​5-​dichloro-
1H-​Pyrrolo[2,​3-​d]​pyrimidine, 4,​5-​dichloro- (9CI); 4,​5-​Dichloro-​7H-​pyrrolo[2,​3-​d]​pyrimidine 

Chemical Formula: C6H3Cl2N3
Exact Mass: 186.97
Molecular Weight: 188.01
m/z: 186.97 (100.0%), 188.97 (64.0%), 190.96 (10.2%), 187.97 (7.6%), 189.97 (4.2%)

InChI: InChI=1S/C6H3Cl2N3/c7-3-1-9-6-4(3)5(8)10-2-11-6/h1-2H,(H,9,10,11)
InChIKey: VFTPONHUNNOSKG-UHFFFAOYSA-N
Canonical SMILES : C1=C(C2=C(N1)N=CN=C2Cl)Cl

Specification

98%

1. (1) Seela, Frank; Helvetica Chimica Acta 1994, V77(4), P897-903 CAPLUS
2. (2) Seela, Frank; Synthesis 2006, (12), P2005-2012 CAPLUS
3. (3) Song, Yang; Synthesis 2011, (9), P1442-1446 CAPLUS
4. (4) Voronkov, Michael V.; Tetrahedron Letters 2006, V47(25), P4149-4151 CAPLUS
5. (5) Harrison, Bryce A.; Journal of Medicinal Chemistry 2009, V52(21), P6515-6518 CAPLUS
6. (6) Pudlo, Jeffrey S.; Journal of Medicinal Chemistry 1988, V31(11), P2086-92 CAPLUS