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CAS Number: 116047-26-8
methyl 8-oxo-5,6,7,8-tetrahydronaphthalene-1-carboxylate

Structure

methyl 8-oxo-5,6,7,8-tetrahydronaphthalene-1-carboxylate
Name: methyl 8-oxo-5,6,7,8-tetrahydronaphthalene-1-carboxylate
Synonyms:
General Information
Product Number: 116047268
CAS Registry Number: 116047-26-8
Name:
        2-​Naphthalenecarboxyli​c acid, 5,​6,​7,​8-​tetrahydro-​8-​oxo-​, methyl ester
        7-​(Carbomethoxy)​-​1-​tetralone; Methyl 1-​oxo-​1,​2,​3,​4-​tetrahydronaphthalen​e-​7-​carboxylate; Methyl 5,​6,​7,​8-​tetrahydro-​8-​oxo-​2-​naphthoate; Methyl 8-​oxo-​5,​6,​7,​8-​tetrahydronaphthalen​e-​2-​carboxylate 
 
Chemical Formula: C12H12O3
Exact Mass: 204.08
Molecular Weight: 204.22
m/z: 204.08 (100.0%), 205.08 (13.2%)
Elemental Analysis: C, 70.57; H, 5.92; O, 23.50
 
InChI: InChI=1S/C12H12O3/c1-15-12(14)9-6-5-8-3-2-4-11(13)10(8)7-9/h5-7H,2-4H2,1H3
InChIKey: CIZUNRVGSYFMQM-UHFFFAOYSA-N
Canonical SMILES : COC(=O)C1=CC2=C(CCCC2=O)C=C1

Specification

98%

References

PCT Int. Appl. (2010), WO 2010090305 A1 20100812.                                  

PCT Int. Appl. (2010), WO 2010090304 A1 20100812.

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