chempirical

Pendimethalin

C13H19N3O4CAS 40487-42-1281.31 g/mol

Open in Covalent MOL file
NHN+OO−N+OO−
NitroSecondary amine

Properties

Molecular formula
C13H19N3O4
Molar mass
281.31 g/mol
Exact mass
281.1376 Da
Density
1.19 g/mL (at 25 °C)
Melting point
56–57 °C
Boiling point
330 °C
logP
3.72Crippen estimate
Polar surface area
98.3 Ų
H-bond donors / acceptors
1 / 5
Rotatable bonds
6

Identifiers

CAS number
40487-42-1
SMILES
CCC(CC)Nc1c([N+](=O)[O-])cc(C)c(C)c1[N+](=O)[O-]
InChIKey
CHIFOSRWCNZCFN-UHFFFAOYSA-N
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

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

37 names · show all
  • Benzenamine, N-(1-ethylpropyl)-3,4-dimethyl-2,6-dinitro-
  • N-(1-Ethylpropyl)-3,4-dimethyl-2,6-dinitrobenzenamine
  • Prowl
  • AC 92553
  • Stomp
  • Penoxalin
  • N-(1-Ethylpropyl)-2,6-dinitro-3,4-xylidine
  • Penoxaline
  • 3,4-Dimethyl-2,6-dinitro-N-(1-ethylpropyl)aniline
  • Phenoxalin
  • Stomp 330E
  • Stomp 330D
  • Stomp 330
  • N-(1-Ethylpropyl)-3,4-dimethyl-2,6-dinitroaniline
  • Accotab
  • Pendimethaline
  • SWGC
  • Southern weed grass control
  • Herbadox
  • Pendulum
  • 3,4-Dimethyl-2,6-dinitro-N-(1′-ethylpropyl)aniline
  • Prowl 3.3
  • Acumen
  • Pendimax
  • Most micro
  • Ornamental weedgrass control
  • OWC
  • Panida
  • Panida 330EC
  • Prowl 400
  • Stomp 330EC
  • Activus EC
  • Gogosan
  • 3,4-Dimethyl-2,6-dinitro-N-(3-pentanyl)aniline
  • 3,4-Dimethyl-2,6-dinitro-N-(pentan-3-yl)aniline
  • Prowl H2O
  • Stomp aqua

Work with Pendimethalin

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Butralin33629-47-943 % similar 3-Nitro-O-xylene83-41-039 % similar Trinitro-M-cresol602-99-339 % similar 2,3-Dinitrotoluene602-01-738 % similar 4,5-Dimethyl-2-nitrobenzenamine6972-71-038 % similar Tnt118-96-738 % similar 4-Chloro-2-methyl-1-nitrobenzene5367-28-237 % similar 4-Chloro-1-methyl-2-nitrobenzene89-59-837 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia