3-Methoxy-2-methylbenzoic Acid 2-(3-methoxy-5-methylbenzoyl)-2-(1,1-dimethylethyl)hydrazide - CAS 163336-71-8
Catalog: |
BB060152 |
Product Name: |
3-Methoxy-2-methylbenzoic Acid 2-(3-methoxy-5-methylbenzoyl)-2-(1,1-dimethylethyl)hydrazide |
CAS: |
163336-71-8 |
Synonyms: |
N'-tert-butyl-3-methoxy-N'-(3-methoxy-5-methylbenzoyl)-2-methylbenzohydrazide; 3-Methoxy-2-methylbenzoic Acid 2-(3-methoxy-5-methylbenzoyl)-2-(1,1-dimethylethyl)hydrazide; 3-Methoxy-5-Methyl-benzoic acid N-tert-butyl-N'-(3- Methoxy-2-Methyl-benzoyl)-hydrazide |
IUPAC Name: | N'-tert-butyl-3-methoxy-N'-(3-methoxy-5-methylbenzoyl)-2-methylbenzohydrazide |
Description: | Used in the synthesis of insecticides due to its hydrazine moiety, and the synthesis of benzoic acid derivatives. |
Molecular Weight: | 384.47 |
Molecular Formula: | C22H28N2O4 |
Canonical SMILES: | CC1=CC(=CC(=C1)OC)C(=O)N(C(C)(C)C)NC(=O)C2=C(C(=CC=C2)OC)C |
InChI: | InChI=1S/C22H28N2O4/c1-14-11-16(13-17(12-14)27-6)21(26)24(22(3,4)5)23-20(25)18-9-8-10-19(28-7)15(18)2/h8-13H,1-7H3,(H,23,25) |
InChI Key: | VFPVUELTFFXJAO-UHFFFAOYSA-N |
References: | Amor, F. et al. Pest. Manag. Sci., 68, 1586 (2012). |
Complexity: | 545 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 384.20490738 |
Formal Charge: | 0 |
Heavy Atom Count: | 28 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 384.20490738 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 67.9Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.2 |
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