| CAS Number: 365998-38-5 methyl 7-chloroisoquinoline-3-carboxylate |
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| General Information | ||||||
| Product Number: 365998385
CAS Registry Number:
365998-38-5
Name:
3-Isoquinolinecarboxylic acid, 7-chloro-, methyl ester
Methyl 7-chloroisoquinoline-3-carboxylate
Chemical Formula: C11H8ClNO2
Exact Mass: 221.02
Molecular Weight: 221.64
m/z: 221.02 (100.0%), 223.02 (32.0%), 222.03 (12.1%), 224.02 (3.9%), 223.03 (1.1%)
Elemental Analysis: C, 59.61; H, 3.64; Cl, 16.00; N, 6.32; O, 14.44
InChI: InChI=1S/C11H8ClNO2/c1-15-11(14)10-5-7-2-3-9(12)4-8(7)6-13-10/h2-6H,1H3
InChIKey: CMOINENCXVRJRP-UHFFFAOYSA-N
Canonical SMILES : COC(=O)C1=NC=C2C=C(C=CC2=C1)Cl
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Specification |
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98% |
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