N-butan-2-yl-4-tert-butyl-2,6-dinitroaniline

CAS: 33629-47-9

Molecular Formula	`C14H21N3O4`
Molecular Weight	295.33 g/mol
LogP	5.1
Topological Polar Surface Area	104.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	4
Exact Mass	295.1532
Heavy Atoms	21
Complexity	359.0

Chemical Identifiers

CAS Number	33629-47-9
SMILES	`CCC(C)NC1=C(C=C(C=C1[N+](=O)[O-])C(C)(C)C)[N+](=O)[O-]`
InChIKey	`SPNQRCTZKIBOAX-UHFFFAOYSA-N`

📖 Product Overview

N-butan-2-yl-4-tert-butyl-2,6-dinitroaniline (CAS: 33629-47-9) is a chemical compound with molecular formula C14H21N3O4 and molecular weight 295.33 g/mol. Its IUPAC systematic name is N-butan-2-yl-4-tert-butyl-2,6-dinitroaniline. LogP 5.1 Topological Polar Surface Area 104.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 5 Rotatable Bonds 4 Exact Mass 295.1532 Heavy Atoms 21 Complexity 359.0 InChI Key: SPNQRCTZKIBOAX-UHFFFAOYSA-N. SMILES: CCC(C)NC1=C(C=C(C=C1[N+](=O)[O-])C(C)(C)C)[N+](=O)[O-].

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