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CAS Number: 74339-45-0
methyl 2-(5-chloro-1H-indol-3-yl)acetate

Structure

methyl 2-(5-chloro-1H-indol-3-yl)acetate
Name: methyl 2-(5-chloro-1H-indol-3-yl)acetate
Synonyms:
General Information
Product Number: 74339450
CAS Registry Number: 74339-45-0
Name:
        1H-​Indole-​3-​acetic acid, 5-​chloro-​, methyl ester
 
Chemical Formula: C11H10ClNO2
Exact Mass: 223.04
Molecular Weight: 223.66
m/z: 223.04 (100.0%), 225.04 (32.4%), 224.04 (12.3%), 226.04 (3.9%)
Elemental Analysis: C, 59.07; H, 4.51; Cl, 15.85; N, 6.26; O, 14.31
 
InChI: InChI=1S/C11H10ClNO2/c1-15-11(14)4-7-6-13-10-3-2-8(12)5-9(7)10/h2-3,5-6,13H,4H2,1H3
InChIKey: QLTNJBDKTUWQFP-UHFFFAOYSA-N
Canonical SMILES : COC(=O)CC1=CNC2=C1C=C(C=C2)Cl

Specification

98%

References

PCT Int. Appl. (2010), WO 2010150837 A1 20101229.

Jpn. Kokai Tokkyo Koho (2011), JP 2011190206 A 20110929. 

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