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CAS Number: 171178-47-5
6-chloropyrido[3,4-d]pyrimidin-4(1H)-one

Structure

 6-chloropyrido[3,4-d]pyrimidin-4(1H)-one
Name: 6-chloropyrido[3,4-d]pyrimidin-4(1H)-one
Synonyms:
General Information
Product Number: 171178475

CAS Registry Number 171178-47-5
Name:
Pyrido[3,?4-?d]?pyrimidin-?4(3H)?-?one, 6-?chloro-
Pyrido[3,4-d]pyrimidin-4(1H)-one, 6-chloro- (9CI)
6-Chloro-3H-pyrido[3,4-d]pyrimidin-4-one

 

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%)

 

InChI:InChI=1S/C7H4ClN3O/c8-6-1-4-5(2-9-6)10-3-11-7(4)12/h1-3H,(H,10,11,12)

InChI Key:BBPUOYYUBFLNML-UHFFFAOYSA-N

Canonical SMILES:C1=C2C(=CN=C1Cl)NC=NC2=O

Specification

98%
References

(1) Rewcastle, Gordon W.; Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry 1996, (18), P2221-2226 CAPLUS
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