1,4-Dinitrobutane structure

1,4-Dinitrobutane

1,4-dinitrobutane

Also Known As: 1,4-Dinitrobutane|Butane, 1,4-dinitro-|1,4-dinitro-butane|Butane,1,4-dinitro|J1.603.417G|S14-1225

CAS: 4286-49-1
Molecular Formula C4H8N2O4
Molecular Weight 148.0484 g/mol
LogP 0.5
Topological Polar Surface Area 91.6 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 3
Exact Mass 148.0484
Monoisotopic Mass 148.0484
Heavy Atoms 10
Complexity 108.0

Chemical Identifiers

CAS Number 4286-49-1
SMILES C(CC[N+](=O)[O-])C[N+](=O)[O-]
InChIKey KWFGJLCFMKVZLQ-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.

Biotechnology (3 patents) Organic Building Blocks (5 patents) Peptides & Amino Acids (1 patents) Polymer Intermediates (7 patents)

Product Overview

1,4-Dinitrobutane (CAS 4286-49-1), with molecular formula C4H8N2O4 and molecular weight 148.0484 g/mol. IUPAC: 1,4-dinitrobutane.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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