Basic information
- CAS
93-26-5- Standard SMILES
COc1ccccc1NC(C)=O- InChIKey
FGOFNVXHDGQVBG-UHFFFAOYSA-N- Molecular formula
- C9H11NO2
- Average molar mass
- 165.19 g/mol
- Monoisotopic mass
- 165.07897859
Overview
N-(2-methoxyphenyl)acetamide is a member of acetamides and a member of methoxybenzenes.
Names & identifiers
- Preferred name
- Acetamide, N-(2-methoxyphenyl)-
- IUPAC
- N-(2-methoxyphenyl)acetamide
- English name
- N-(2-Methoxyphenyl)acetamide
- Molecular formula
- C9H11NO2
- Molecular weight
- 165.19
Names & synonyms
N-(2-Methoxyphenyl)acetamide93-26-5o-ACETANISIDIDEo-Methoxyacetanilide2-MethoxyacetanilideAcetamide, N-(2-methoxyphenyl)-Acetanilide, 2'-methoxy-NSC 4004EINECS 202-233-5LPJ345W2VYBRN 2091808AI3-00799
Show more names
o-Acetaniside2-Acetaniside2-acetanisidide2-AcetanisidineAcetylanisidineo-acetanisidineO-Acetonisidineo-AcetoanisidideN-Acetylanisidine
NSC-4004DTXSID0052623oAcetanisidideoAcetanisidineoMethoxyacetanilide2'MethoxyacetanilideAcetanilide, 2'methoxyRefChem:551687
Database identifiers
- CAS
93-26-5- PubChem CID
- 7135
- DTXSID
DTXSID0052623- ChEMBL
CHEMBL1880779- ChEBI
CHEBI:143106- UNII
- LPJ345W2VY
- EC Number
- 202-233-5
- Nikkaji
- J4.671J
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 159
Experimental & physicochemical properties
Chemical ClassesNitrogen Compounds -> Other Aromatics (Nitrogen)
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
LogP1.02
Vapor Pressure0.0000659 [mmHg]
Physical DescriptionTan powder; [Sigma-Aldrich MSDS]
Physicochemical properties
- Melting point
- 70 · 70-74 °C (lit.)
- Boiling point
- 303 · 303-305 °C (lit.)
- Density
- 1.1603 · 1.1603 (rough estimate)
- refractive index
- 1.5839 · 1.5839 (estimate)
- storage temp.
- Sealed in dry,Room Temperature
- form
- powder to crystal
- pka
- 14.5 · 14.50±0.70(Predicted)
- color
- White to Almost white
- InChI
- InChI=1S/C9H11NO2/c1-7(11)10-8-5-3-4-6-9(8)12-2/h3-6H,1-2H3,(H,10,11)
- InChIKey
- FGOFNVXHDGQVBG-UHFFFAOYSA-N
- SMILES
- C(NC1=CC=CC=C1OC)(=O)C
- CAS DataBase Reference
- 93 · 93-26-5(CAS DataBase Reference)
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 345 W2VY · LPJ345W2VY
- NIST Chemistry Reference
- o-Acetanisidine(93-26-5)
- EPA Substance Registry System
- Acetamide, N-(2-methoxyphenyl)- (93-26-5)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P270-P301+P312-P302+P352-P305+P351+P338
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22-36/37/38
- Safety Statements
- 26 · 26-36
- WGK Germany
- 3 · 3
- RTECS
- 8280000 · AE8280000
- TSCA
- TSCA listed
- HS Code
- 2924.29 · 2924.29.7790
- Toxicity
- 50 orl-mus: · LD50 orl-mus: 940 mg/kg TXAPA9 19,20,71
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazards SummaryA skin and strong eye irritant; Harmful by ingestion; [Sigma-Aldrich MSDS]
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- AE8280000
- hs_code
- 2924.29.7790
- Toxicity
- LD50 orl-mus: 940 mg/kg TXAPA9 19,20,71
- risk_code
- 22-36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 26-36
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P264-P270-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationAcetamide, N-(2-methoxyphenyl)-: INACTIVE
Applications
Uses2-Acetamidoanisole has been used in various experiments as a preparatory step for making products, such as, paper and rubber anti-skid safety shoes.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers78 total
国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
成都彼样生物科技有限公司18108052721 · [email protected]
泰州葛林美克医药科技有限公司15366892466
上海腾准生物科技有限公司19821570922 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
环生美森医药技术（山东）有限公司0531-88762217 18301471076 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Syntechem Co.,Ltd[email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
上海隆盛化工有限公司58099637 13585536065 · [email protected]
湖北成海化工有限公司027-59220433 18327245847 · [email protected]
菏泽博纳医药科技有限公司15865805009 · [email protected]
湖北微斯汀科技有限公司027-61182895 13367240285 · [email protected]
孝感深远化工有限公司15527621225; 15527621225 · [email protected]
云南西力生物技术股份有限公司0871-65217109 · [email protected]
山东西亚化学有限公司13355009207 13355009207 · [email protected]
玛雅试剂+86 (573) 82222445 (0)18006601000 452520369 · [email protected]
天津希恩思生化科技有限公司400 638 7771 · [email protected]
ZHEJIANG JIUZHOU CHEM CO., LTD+86-0576225566889 +86-13454675544 · [email protected]；[email protected]；[email protected]
上海威翼化工有限公司18621196961 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
苏州亚科科技股份有限公司0512-87182055 13451648594 · [email protected]
北京奥秘佳得医药科技有限公司+86-13522808617 · [email protected]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
阳谷荣科商贸有限公司15863541132 · [email protected]
青岛海智微元生物科技有限公司18317699790 18317699790 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
康迪斯化工(湖北)有限公司13343438265 · [email protected]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
广东翁江化学试剂有限公司0751-2886766 13927870850 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
sgtlifesciences pvt ltd+91-8790379245 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
菏泽星达医药科技有限公司13583079096 · [email protected]
湖北齐飞医药化工有限公司027-59322506 18071128681 · [email protected]
上海贤鼎生物科技有限公司021-021-52271985 17721149837 · [email protected]
湖北东曹化学科技有限公司027-83238443 13343438265 · [email protected]
嘉兴市德亿化工有限公司86-0573-85866609 18367600069 · [email protected]
Additional notes
DefinitionChEBI: N-(2-methoxyphenyl)acetamide is a member of methoxybenzenes and a member of acetamides.
Related reactions
13 records
Compound notes
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