| CAS Number: 103261-67-2 methyl 4-cyano-2-methylbenzoate |
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| General Information | ||||||
| Product Number: 103261672
CAS Registry Number: 103261-67-2
Name:
Benzoic acid, 4-cyano-2-methyl-, methyl ester
o-Toluic acid, 4-cyano-, methyl ester (6CI); 4-Cyano-2-methyl-benzoic acid methyl ester; Methyl 4-cyano-2-methylbenzoate
Chemical Formula: C10H9NO2
Exact Mass: 175.06
Molecular Weight: 175.18
m/z: 175.06 (100.0%), 176.07 (11.0%)
Elemental Analysis: C, 68.56; H, 5.18; N, 8.00; O, 18.27
InChI: InChI=1S/C10H9NO2/c1-7-5-8(6-11)3-4-9(7)10(12)13-2/h3-5H,1-2H3
InChIKey: PDQNYPAJSAVURS-UHFFFAOYSA-N
Canonical SMILES : CC1=C(C=CC(=C1)C#N)C(=O)OC
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Specification |
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98% |
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| References | ||||||
(1) Sun, Xicheng; Bioorganic & Medicinal Chemistry Letters 2011, V21(12), P3671-3675 CAPLUS |
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