Molecular properties
- Formula
- C13H19N3O4
- Molar mass
- 281.31 g·mol−1
- Exact mass
- 281.1375 Da
- 6
- PubChem CID
- 38479
Molecule record
3,4-dimethyl-2,6-dinitro-N-pentan-3-ylaniline
C13H19N3O4
281.31 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Aromatic ring
Nitro compound
Secondary amine
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 3,4-Dimethyl-2,6-dinitro-N-(1-ethylpropyl)aniline
- 40487-42-1
- Accotab
- Caswell No. 454BB
- DTXSID7024245
- Go-Go-San
- Herbadox
- N-(1-Ethylpropyl)-2,6-dinitro-3,4-xylidine
Show all 24 synonyms
- N-(1-Ethylpropyl)-3,4-dimethyl-2,6-dinitrobenzenamine
- PENDIMETHALIN
- Pendimethaline
- Penoxaline
- Penoxyn
- Phenoxalin
- Prowl
- SWGC
- Sipaxol
- Southern Weed Grass Control
- Stomp
- Stomp 330D
- Stomp 330E
- Tendimethalin
- Way Up
- Wayup
Structure identifiers
- Canonical SMILES
- CCC(CC)Nc1c([N+](=O)[O-])cc(C)c(C)c1[N+](=O)[O-]
- Isomeric SMILES
- CCC(CC)NC1=C(C=C(C(=C1[N+](=O)[O-])C)C)[N+](=O)[O-]
- InChI
- InChI=1S/C13H19N3O4/c1-5-10(6-2)14-12-11(15(17)18)7-8(3)9(4)13(12)16(19)20/h7,10,14H,5-6H2,1-4H3
- InChIKey
- CHIFOSRWCNZCFN-UHFFFAOYSA-N
- PubChem CID
- 38479
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for 3,4-dimethyl-2,6-dinitro-N-pentan-3-ylaniline; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 3,4-dimethyl-2,6-dinitro-N-pentan-3-ylaniline; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.