Basic information
- CAS
32428-71-0- Standard SMILES
CCc1cccc(C)c1NC(=O)CCl- InChIKey
SMINYPCTNJDYGK-UHFFFAOYSA-N- Molecular formula
- C11H14ClNO
- Average molar mass
- 211.69 g/mol
- Monoisotopic mass
- 211.07639175
Overview
N-(2-ethyl-6-methylphenyl)-2-chloroacetamide is an aromatic amide obtained by formal condensation of the carboxy group of chloroacetic acid with the amnio group of 2-ethyl-6-methylaniline. It is an organochlorine compound and an aromatic amide. It is functionally related to a chloroacetic acid.
Names & identifiers
- Preferred name
- 2-Chloro-N-(2-ethyl-6-methylphenyl)acetamide
- IUPAC
- 2-chloro-N-(2-ethyl-6-methylphenyl)acetamide
- English name
- 2-ETHYL-6-METHYL-2-CHLOROACETANILIDE
- Molecular formula
- C11H14ClNO
- Molecular weight
- 211.69
Names & synonyms
2-chloro-N-(2-ethyl-6-methylphenyl)acetamideDTXSID60186172RefChem:470030DTXCID7010866332428-71-02-Ethyl-6-Methyl-2-ChloroacetanilideAcetamide, 2-chloro-N-(2-ethyl-6-methylphenyl)-MFCD00267498N-chloroacetyl-2-ethyl-6-methylaniline2-chloro-2'-ethyl-6'-methylacetanilideSCHEMBL65460272-Chloro-N-(2-ethyl-6-methyl-phenyl)-acetamide
Show more names
SKL909CGA 13656Verapamil Impurity 40Des(ethoxy)methyl AcetochlorN-(Chloroacetyl)-2-ethyl-6-methylaniline2-CHLORO-(N-2-METHYL-6-ETHYL PHENYL)ACETAMIDE2-chloro-N-(2-ethyl-6-methyl-phenyl)ethanamide
CMEPA2-chloro-N-(6-ethyl-2-methylphenyl)acetamideN-(2-ethyl-6-methylphenyl)-2-chloroacetamideSCHEMBL30323772CHEBI:136494SMINYPCTNJDYGK-UHFFFAOYSA-NALBB-002413BBL007583
Database identifiers
- CAS
32428-71-0- PubChem CID
- 670477
- DTXSID
DTXSID60186172- ChEBI
CHEBI:136494- EC Number
- 693-756-1
- Nikkaji
- J1.364.875A
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 196
Experimental & physicochemical properties
PesticidesPesticide degradation product
Physicochemical properties
- Melting point
- 120 · 120-121 °C(Solv: ethanol, 50% (64-17-5))
- Boiling point
- 343.1 · 343.1±37.0 °C(Predicted)
- Density
- 1.156 · 1.156±0.06 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- solubility
- Chloroform (Slightly), Methanol (Slightly, Heated)
- form
- Solid
- pka
- 12.91 · 12.91±0.70(Predicted)
- color
- Off-White to Pale Red
- InChI
- InChI=1S/C11H14ClNO/c1-3-9-6-4-5-8(2)11(9)13-10(14)7-12/h4-6H,3,7H2,1-2H3,(H,13,14)
- InChIKey
- SMINYPCTNJDYGK-UHFFFAOYSA-N
- SMILES
- C(NC1=C(C)C=CC=C1CC)(=O)CCl
- CAS DataBase Reference
- 32428 · 32428-71-0
- EPA Substance Registry System
- 2 · Acetamide, 2-chloro-N-(2-ethyl-6-methylphenyl)- (32428-71-0)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P
Safety & regulation
GHS classification
GHS Classification
Warning
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesEye Irrit. 2 (100%)
Toxicology
USGS Health-Based Screening Levels for Evaluating Water-Quality
2-Chloro-N-(2-ethyl-6-methylphenyl)acetamide
Pesticide degradation product
Smith, C.D. and Nowell, L.H., 2024. Health-Based Screening Levels for evaluating water-quality data (3rd ed.). DOI:10.5066/F71C1TWP
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Pharmacology
Metabolism/Metabolites2-Chloro-N-(2-ethyl-6-methylphenyl)acetamide is a known human metabolite of Acetachlor.
Applications
Uses2-Ethyl-6-methyl-2-chloroacetanilide is an intermediate of the herbicides acetochlor, metolachlor and metolachlor.
Upstream & downstream products
Upstream raw materials
Suppliers71 total
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
湖北威德利化学试剂有限公司181-6332-1995 18062128043 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
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成都思天德生物科技有限公司028-83243028 19136088901 · [email protected]
Shanghai Witofly Chemical Co.,Ltd[email protected]
上海睿升化工科技有限公司+86-021-50935922
上海倍卓生物科技有限公司021-61119791,13386096464 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
南京多隆生物科技有限公司18905173768 · [email protected]
郑州康弗辰医药科技有限公司18210788515; 18210788515 · [email protected]
Henan Alfa Chemical Co., Ltd+8618339805032 · [email protected]
广东翁江化学试剂有限公司0751-2886766 13927870850 · [email protected]
艾吉析科技（上海）有限公司17721401538;17717235263 17721401538 · [email protected]
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上海颖心实验室设备有限公司021-021-59178156 15300768757 · [email protected]
格莱斯兰德（天津）医药科技有限公司022-83705301 13752403750
烟台盛凯伦化学科技有限公司13356901049 · [email protected]
上海潜莱医药科技有限公司482109853 · [email protected]
上海策嵘生物科技有限公司（定制合成实验室）13062833949 · [email protected]
山东小野化学股份有限公司0539-6362799 20）
上海尊理加生命科技有限公司021-34045219 13062664914 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [email protected]
上海百舜生物科技有限公司021-37581181 · [email protected]
深圳市丽晶生化科技有限公司0755-85201366 18938635012 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 13913916777 · [email protected]
上海吉至生化科技有限公司021-4009004166/18616739031 18616739031 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
浙江泽天精细化工有限公司18957127338 · [email protected]
Nanjing Dolon Biotechnology Co.,Ltd.18905173768 · [email protected]
Aladdin Scientific[email protected]
湖北达豪化工有限公司027-027-59106191 13986034860 · [email protected]
Additional notes
DefinitionChEBI: N-(2-ethyl-6-methylphenyl)-2-chloroacetamide is an aromatic amide obtained by formal condensation of the carboxy group of chloroacetic acid with the amnio group of 2-ethyl-6-methylaniline. It is an aromatic amide and an organochlorine compound. It is functionally related to a chloroacetic acid.
Related reactions
4 records
Compound notes
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