Metolachlor
PubChem CID: 4169
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| Compound Synonyms | metolachlor, 51218-45-2, Pennant, Yibingjiacaoan, Codal, Dual, Dual Magnum, Dual Triple, Metelilachlor, Dual II, 2-chloro-N-(2-ethyl-6-methylphenyl)-N-(1-methoxypropan-2-yl)acetamide, Ontrack 8E, Dual 720EC, Humextra, Dual 8E, Dual 960 EC, Metolachlor technical, Metetilachlor, Metolachlore, Jindual, Metoken, 2-Chloro-N-(2-ethyl-6-methylphenyl)-N-(2-methoxy-1-methylethyl)acetamide, Metolachlor [ISO], N-(1-Methyl-2-methoxyethyl)-N-chloroacetyl-2-ethyl-6-methylaniline, CGA 24705, CGA-24705, Acetamide, 2-chloro-N-(2-ethyl-6-methylphenyl)-N-(2-methoxy-1-methylethyl)-, METOLACHOR, DTXSID4022448, X0I01K05X2, METOLACHLOR [MI], METOLACHLOR [HSDB], DTXCID402448, CHEBI:83645, Metolachlor, herbicide (C15-H22-N-O2-Cl), 2-Chloro-6'-ethyl-N-(2-methoxy-1-methylethyl)-o-acetotoluidine, 82535-90-8, 2-chloro-N-(2-ethyl-6-methyl-phenyl)-N-(2-methoxy-1-methyl-ethyl)acetamide, Acetamide,2-chloro-N-(2-ethyl-6-methylphenyl)-N-(2-methoxy-1-methylethyl)-, Acetamide, 2-chloro-N-(2-ethyl-6-methylphenyl)-N-(2-methoxy-1-methylethyl)-, stereoisomer, Caswell No. 188DD, 2-CHLORO-6-ETHYL-N-(2-METHOXY-1-METHYLETHYL)ACET-O-TOLUIDIDE, Metolachlore [ISO-French], .ALPHA.-CHLORO-2-ETHYL-6-METHYL-N-(1-METHYL-2-METHOXYETHYL)ACETANILIDE, CAS-51218-45-2, Metolachlor [ANSI:BSI:ISO], HSDB 6706, EINECS 257-060-8, EPA Pesticide Chemical Code 108801, BRN 2743537, Metolaclor, Pimagram, UNII-X0I01K05X2, Bicep 6L, Bicep (Salt/Mix), Turbo (Salt/Mix), CGA-77102, MFCD00055293, Pace 6L, Dual 25G, Primagram (Salt/Mix), Primextra (Salt/Mix), (aS,5S)-Metolachlor, Spectrum_001833, Metolaclor (Salt/Mix), SpecPlus_000434, 2-Chloro-6'-ethyl-N-(2-methoxy-1-methylethyl)acet-o-toluidide, Pace 6L (Salt/Mix), Bicep 6L (Salt/Mix), 2-Ethyl-6-methyl-1-N-(2-methoxy-1-methylethyl)chloroacetanilide, Spectrum2_001885, Spectrum3_000827, Spectrum4_000667, Spectrum5_001966, 2-Aethyl-6-methyl-N-(1-methyl-2-methoxyaethyl)-chloracetanilid [German], Acetamide, 2-chloro-N-(6-ethyl-o-tolyl)-N-(2-methoxy-1-methylethyl)-, Dual 25G (Salt/Mix), N-(2'-Methoxy-1'-methylethyl)-2'-ethyl-6'-methyl-2-chloroacetanilide, 2-Etylo-6-metylo-N-(1'-metylo-2'-metoksyetylo)chloroacetanilid [Polish], alpha-Chlor-6'-aethyl-N-(2-methoxy-1-methylaethyl)-acet-o-toluidin [German], alpha-Chloro-2'-ethyl-6'-methyl-N-(1-methyl-2-methoxyethyl)-acetanilide, Metolachlor standard solution, SCHEMBL21385, BSPBio_002353, KBioGR_001073, KBioSS_002338, SPECTRUM330035, DivK1c_006530, SPBio_001790, CHEBI:6902, Metolachlor, analytical standard, CHEMBL1884974, KBio1_001474, KBio2_002335, KBio2_004903, KBio2_007471, KBio3_001853, 2-Aethyl-6-methyl-N-(1-methyl-2-methoxyaethyl)-chloracetanilid, 2-chloro-N-(2-ethyl-6-methylphenyl)-N-(2-methoxyethyl)acetamide, 2-Etylo-6-metylo-N-(1'-metylo-2'-metoksyetylo)chloroacetanilid, BCA21845, CGA24705, HY-B1871, MSK22402, UYB80397, Tox21_201376, Tox21_300982, alpha-Chlor-6'-aethyl-N-(2-methoxy-1-methylaethyl)-acet-o-toluidin, CCG-39423, o-Acetotoluidide, 2-chloro-6'-ethyl-N-(2-methoxy-1-methylethyl)-, AKOS015888371, Acetamide, 2-chloro-N-(2-ethyl-6-methylphenyl)-N-((1S)-2-methoxy-1-methylethyl)-, (N(S))-, Metolachlor 1000 microg/mL in Acetone, USEPA/OPP Pesticide Code: 108801, Metolachlor 10 microg/mL in Cyclohexane, NCGC00095767-01, NCGC00095767-02, NCGC00095767-03, NCGC00095767-04, NCGC00095767-05, NCGC00095767-06, NCGC00254884-01, NCGC00258927-01, 1ST22402, BS-42451, Metolachlor 10 microg/mL in Acetonitrile, Metolachlor 100 microg/mL in Cyclohexane, Metolachlor 100 microg/mL in Acetonitrile, DB-051924, CS-0013937, M3381, NS00000248, E84049, Metolachlor, PESTANAL(R), analytical standard, EN300-18537345, Q409598, 2Chloro6'ethylN(2methoxy1methylethyl)acetotoluidide, 2Chloro6'ethylN(2methoxy1methylethyl)oacetotoluidine, 2Aethyl6methylN(1methyl2methoxyaethyl)chloracetanilid, 2Ethyl6methyl1N(2methoxy1methylethyl)chloroacetanilide, 2Etylo6metyloN(1'metylo2'metoksyetylo)chloroacetanilid, alphaChlor6'aethylN(2methoxy1methylaethyl)acetotoluidin, BRD-A43135847-001-02-3, oAcetotoluidide, 2chloro6'ethylN(2methoxy1methylethyl), Acetamide, 2chloroN(6ethylotolyl)N(2methoxy1methylethyl), N(1Methyl2methoxyethyl)Nchloroacetyl2ethyl6methylaniline, Z3234876186, alphaChloro2'ethyl6'methylN(1methyl2methoxyethyl)acetanilide, N(2'Methoxy1'methylethyl)2'ethyl6'methyl2chloroacetanilide, 2ChloroN(2ethyl6methylphenyl)N(2methoxy1methylethyl)acetamide, 2-chloro-2'-ethyl-6'-methyl-N-(1-methyl-2-methoxyethyl)acetanilide, 2-chloro-6'-ethyl-n-(2-methoxy-1-methylethyl)aceto-o-toluidide, 2-chloro-2'-ethyl-6'-methyl-N-(1-methyl-2-methoxyethyl)-acetanilide, 2-chloro-N-(2-ethyl-6-methyl-phenyl)-N-(1-methoxypropan-2-yl) acetamide, alpha-Chloro-2'-ethyl-6'-methyl-N-(1-methyl-2-methoxyethyl)acetanilide, rac-2-chloro-N-(2-ethyl-6-methylphenyl)-N-(1-methoxypropan-2-yl)acetamide, 2-Chloro-N-(2-ethyl-6-methylphenyl)-N-[1-(methoxymethyl-d2)ethyl-1,2,2,2-d4]acetamide, ALPHA-CHLORO-2-ETHYL-6-METHYL-N-(1-METHYL-2-METHOXYETHYL)ACETANILIDE, 257-060-8 |
|---|---|
| Topological Polar Surface Area | 29.5 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 19.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 285.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Uniprot Id | P10275, Q03181, P37231, Q16236, P46225, Q9NUW8, Q9Y6L6, Q9NPD5 |
| Iupac Name | 2-chloro-N-(2-ethyl-6-methylphenyl)-N-(1-methoxypropan-2-yl)acetamide |
| Prediction Hob | 1.0 |
| Xlogp | 3.1 |
| Molecular Formula | C15H22ClNO2 |
| Prediction Swissadme | 1.0 |
| Inchi Key | WVQBLGZPHOPPFO-UHFFFAOYSA-N |
| Fcsp3 | 0.5333333333333333 |
| Logs | -2.554 |
| Rotatable Bond Count | 6.0 |
| Logd | 2.589 |
| Compound Name | Metolachlor |
| Prediction Hob Swissadme | 1.0 |
| Exact Mass | 283.134 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 283.134 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 283.79 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -3.343138010526315 |
| Inchi | InChI=1S/C15H22ClNO2/c1-5-13-8-6-7-11(2)15(13)17(14(18)9-16)12(3)10-19-4/h6-8,12H,5,9-10H2,1-4H3 |
| Smiles | CCC1=CC=CC(=C1N(C(C)COC)C(=O)CCl)C |
| Nring | 1.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Oryza Sativa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all