3-Methoxy-2-methylbenzoic Acid 2-(3-Methylbenzoyl)-2-(1,1-Dimethylethyl)hydrazide - CAS 163336-51-4
Catalog: |
BB060150 |
Product Name: |
3-Methoxy-2-methylbenzoic Acid 2-(3-Methylbenzoyl)-2-(1,1-Dimethylethyl)hydrazide |
CAS: |
163336-51-4 |
Synonyms: |
N'-(tert-butyl)-3-methoxy-2-methyl-n'-(3-methylbenzoyl)benzohydrazide; 3-Methoxy-2-methylbenzoic Acid 2-(3-Methylbenzoyl)-2-(1,1-Dimethylethyl)hydrazide; N'-tert-butyl-3-methoxy-2-methyl-N'-(3-methylbenzoyl)benzohydrazide; N'-(t-Butyl)-3-methoxy-2-methyl-N'-(3-methylbenzoyl)benzohydrazide |
IUPAC Name: | N'-tert-butyl-3-methoxy-2-methyl-N'-(3-methylbenzoyl)benzohydrazide |
Description: | Used in the synthesis of insecticides due to its hydrazine moiety, and the synthesis of benzoic acid derivatives. |
Molecular Weight: | 354.44 |
Molecular Formula: | C21H26N2O3 |
Canonical SMILES: | CC1=CC(=CC=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C(=CC=C2)OC)C |
InChI: | InChI=1S/C21H26N2O3/c1-14-9-7-10-16(13-14)20(25)23(21(3,4)5)22-19(24)17-11-8-12-18(26-6)15(17)2/h7-13H,1-6H3,(H,22,24) |
InChI Key: | CDUYORZAQRQNFH-UHFFFAOYSA-N |
References: | Amor, F. et al. Pest. Manag. Sci., 68, 1586 (2012). |
Complexity: | 500 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 354.1943427 |
Formal Charge: | 0 |
Heavy Atom Count: | 26 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 354.1943427 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 58.6Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.2 |
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