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

Technical Data

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:	58.6Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	4.2