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CAS Number: 908287-21-8
4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbaldehyde

Structure

4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbaldehyde
Name: 4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbaldehyde
Synonyms:
General Information
Product Number: 908287218
CAS Number:
908287-21-8
Name:
1H-Pyrrolo[2,3-d]pyrimidine-5-carboxaldehyde, 4-chloro-
1H-Pyrrolo[2,3-d]pyrimidine-5-carboxaldehyde, 4-chloro- (9CI); 4-Chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxaldehyde 
Chemical Formula: C7H4ClN3O
Exact Mass: 181.00
Molecular Weight: 181.58
m/z: 181.00 (100.0%), 183.00 (32.0%), 182.01 (7.7%), 184.00 (2.8%), 182.00 (1.1%)
Elemental Analysis: C, 46.30; H, 2.22; Cl, 19.52; N, 23.14; O, 8.81
 
MDL:MFCD12406099
InChI: InChI=1S/C7H4ClN3O/c8-6-5-4(2-12)1-9-7(5)11-3-10-6/h1-3H,(H,9,10,11)
InChIKey: SEGITDCEHFAQNG-UHFFFAOYSA-N
Canonical SMILES : C1=C(C2=C(N1)N=CN=C2Cl)C=O

Specification

98%

References

PCT Int. Appl. (2013), WO 2013012915 A1 20130124. 

PCT Int. Appl. (2012), WO 2012064973 A2 20120518.

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