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Imidacloprid
CAS: 138261-41-3 | C9H10ClN5O2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
138261-41-3
Molecular Formula:
C9H10ClN5O2
Molecular Weight:
255.66500000000002 g/mol
Names and Synonyms:
Imidacloprid
Synonym
(2E)-1-[(6-Chloro-3-pyridinyl)methyl]-N-nitro-2-imidazolidinimine
Synonym
2-Imidazolidinimine, 1-[(6-chloro-3-pyridinyl)methyl]-N-nitro-, (2E)-
Synonym
BAY-NTN 33893
Synonym
Merit
Synonym
Imidacloprid
Synonym
NTN 33893
Synonym
1-[(6-Chloro-3-pyridinyl)methyl]-N-nitro-2-imidazolidinimine
Synonym
Gaucho
Synonym
Confidor 200SL
Synonym
Confidor
Synonym
Admire
Synonym
Provado
Synonym
Merit (insecticide)
Synonym
Confidor SL
Synonym
CP 1
Synonym
NTN 33893-240FS
Synonym
Advantage Flea Adulticide
Synonym
1-[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-N-nitro-1H-imidazol-2-amine
Synonym
Premise
Synonym
Meritgreen
Synonym
Hachikusan
Synonym
1-(2-Chloro-5-pyridylmethyl)-2-(N-nitroimino)imidazolidine
Synonym
Baimieshi
Synonym
Prescribe
Synonym
Trimax
Synonym
Trimax (pesticide)
Synonym
Pro-Agro
Synonym
Imicide
Synonym
Admire 2F
Synonym
Premis
Synonym
Premise (insecticide)
Synonym
Gaucho Grande
Synonym
Genesis
Synonym
Marathon II
Synonym
Preventol TM
Synonym
Grubex
Synonym
Bayer Advanced Season-Long Grub control
Synonym
AGST 03001
Synonym
Genesis (pesticide)
Synonym
Rinfidor
Synonym
Comodor
Synonym
Admire Pro
Synonym
Quick-Bayt
Synonym
Marathon
Synonym
Marathon (insecticide)
Synonym
Trimax Pro
Synonym
NUP 06024
Synonym
Nuprid
Synonym
NUP 06023
Synonym
Alias 2F
Synonym
AEF 106464
Synonym
Couraze
Synonym
Mallet 2F
Synonym
Pasada
Synonym
Confidate
Synonym
Alias
Synonym
NUQ 05054
Synonym
Widow
Synonym
Macho Max
Synonym
Torrent
Synonym
Advise
Synonym
CoreTect
Synonym
1-(6-Chloro-3-pyridylmethyl)-N-nitroimidazolidin-2-ylideneamine
Synonym
AE-F 106464-00GR01B0
Synonym
Couraze Max
Synonym
Senator
Synonym
Confidor 240 O-TEQ
Synonym
Confidor 200 O-TEQ
Synonym
Timbertreat N 98
Synonym
Senator (neonicotinoid)
Synonym
Jade
Synonym
Gaucho 600FS
Synonym
Kohinor
Synonym
Confidor 70WG
Synonym
Biunik 200SL
Synonym
Provado 2F
Synonym
Tanrec
Synonym
Lada
Synonym
Lada (insecticide)
Synonym
Kumiai Admire
Synonym
Enforce (pesticide)
Synonym
Enforce
Synonym
Yashijing
Synonym
Confidor 100SL
Synonym
Confidor 350SC
Synonym
Acceleron IX 409
Synonym
Merit 2F
Synonym
Biotlin
Synonym
Merit 75WP
Synonym
1-[(6-Chloro-3-pyridyl)methyl]-N-nitro-2-imidazolidineimine
Synonym
Imidamex
Synonym
Imida Nova 60
Synonym
TM 0314
Synonym
Suscon Maxi
Synonym
Senator WG
Synonym
IX 104
Synonym
Confidence 555
Synonym
Identifiers:
SMILES:
O=[N+]([O-])NC1=NCCN1Cc1ccc(Cl)nc1
InChI:
InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
Physical Properties
| Property | Value | Source |
|---|---|---|
| molecular_mass | 255.67 g/mol | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Imidacloprid None | Legacy Database |
| cas-canonical-smile | O=N(=O)N=C1NCCN1CC2=CN=C(Cl)C=C2 None | Legacy Database |
| cas-inchi | InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13) None | Legacy Database |
| cas-inchi-key | InChIKey=YWTYJOPNNQFBPC-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | 144 °C None | Legacy Database |
| cas-name | Imidacloprid None | Legacy Database |
| wikipedia-name | Imidacloprid None | Legacy Database |
| LogP | 0.6879 | RDKit |
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 255.66500000000002 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 255.05230224 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 17 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 5 count | RDKit |
| Hydrogen Bond Donors | 1 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 3 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 1 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 83.66 Ų | RDKit |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 62.089100000000016 | RDKit |