HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

2-Ethoxybenzamide

HCID 3282
NotesReactions
Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
938-73-8
Standard SMILES
CCOc1ccccc1C(N)=O
InChIKey
SBNKFTQSBPKMBZ-UHFFFAOYSA-N
Molecular formula
C9H11NO2
Average molar mass
165.19 g/mol
Monoisotopic mass
165.07897859

Overview

2-ethoxybenzamide appears as white or almost-white crystalline powder. Almost odorless. Tasteless. (NTP, 1992)

Names & identifiers

Preferred name
2-Ethoxybenzamide
IUPAC
2-ethoxybenzamide
English name
2-Ethoxybenzamide
Molecular formula
C9H11NO2
Molecular weight
165.19

Names & synonyms

2-ETHOXYBENZAMIDEethenzamide938-73-8o-EthoxybenzamideBenzamide, 2-ethoxy-EthbenzamideEtenzamideEthenzamidEthosalicylLucamidePirosolvinaEtamide
Show more names
h.p.209H.P. 209Lindatox
AnovigamEtosalicilEtosalicylKatagrippeProtopyrinTrancalgylEtocilEusal

Database identifiers

CAS
938-73-8
PubChem CID
3282
DTXSID
DTXSID4020581
ChEMBL
CHEMBL1483877
ChEBI
CHEBI:31564
UNII
L929ZCK4BF
EC Number
213-346-4
Nikkaji
J3.352I

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
52.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
12
Formal charge
0
Complexity
159

Experimental & physicochemical properties

LogP1.34
Solubilityless than 1 mg/mL at 61 °F (NTP, 1992)
Melting Point270 to 273 °F (NTP, 1992)
Physical Description2-ethoxybenzamide appears as white or almost-white crystalline powder. Almost odorless. Tasteless. (NTP, 1992)

Physicochemical properties

Melting point
132 · 132-134 °C (lit.)
Boiling point
293.03 °C · 293.03°C (rough estimate)
Density
1.1603 · 1.1603 (rough estimate)
refractive index
1.562 · 1.5620 (estimate)
storage temp.
Sealed in dry,Room Temperature
solubility
Chloroform (Slightly), Dichloromethane (Slightly)
form
Granular Crystalline Powder
pka
15.62 · 15.62±0.50(Predicted)

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 3 items

This chemical does not meet GHS hazard criteria for 100% (24 of 24) of all reports.

Not Classified

Aggregated GHS information provided per 24 reports by companies from 1 notifications to the ECHA C&L Inventory.

Hazard information

Regulatory InformationBenzamide, 2-ethoxy-: Does not have an individual approval but may be used under an appropriate group standard
Fire HazardsFlash point data for this chemical are not available; however, it is probably combustible. (NTP, 1992)
Health HazardsACUTE/CHRONIC HAZARDS: When heated to decomposition this compound emits toxic fumes of nitrogen oxides. (NTP, 1992)
Reactive GroupAmides and Imides
Reactivity Profile · 1 item

2-ETHOXYBENZAMIDE is an amide. Amides/imides react with azo and diazo compounds to generate toxic gases. Flammable gases are formed by the reaction of organic amides/imides with strong reducing agents. Amides are very weak bases (weaker than water). Imides are less basic yet and in fact react with strong bases to form salts. That is, they can react as acids. Mixing amides with dehydrating agents such as P2O5 or SOCl2 generates the corresponding nitrile. The combustion of these compounds generates mixed oxides of nitrogen (NOx).

Air and Water ReactionsInsoluble in water.
Hazard Classes and CategoriesNot Classified

Chemistry & industry

Pharmacology

ATC Code · 2 items

N - Nervous system

QN - Nervous system

MeSH Pharmacological Classification · 1 item

Anti-inflammatory agents that are non-steroidal in nature. In addition to anti-inflammatory actions, they have analgesic, antipyretic, and platelet-inhibitory actions. They act by blocking the synthesis of prostaglandins by inhibiting cyclooxygenase, which converts arachidonic acid to cyclic endoperoxides, precursors of prostaglandins. Inhibition of prostaglandin synthesis accounts for their analgesic, antipyretic, and platelet-inhibitory actions; other mechanisms may contribute to their anti-inflammatory effects.

Uses & manufacturing

General Manufacturing InformationBenzamide, 2-ethoxy-: INACTIVE

Applications

General DescriptionWhite or almost-white crystalline powder. Almost odorless. Tasteless.

Upstream & downstream products

Upstream raw materials

Solid sodium hydroxideSalicylamideChloroethaneBromoethaneDiethyl sulfateBenzamide, 2-(ethenyloxy)- (9CI)2-Ethoxy-1-ethynyl-benzene

Related reactions

2 records
New reaction record
HRID 124910 reaction equation
HRID 124910As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 1957946 reaction equation
HRID 1957946As reactantuspto-grants-2013_04

Compound notes

Loading…

On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
color
White to almost white
Water Solubility
0.1 g/100 · <0.1 g/100 mL at 16 ºC
Merck
14 · 14,3731
InChI
InChI=1S/C9H11NO2/c1-2-12-8-6-4-3-5-7(8)9(10)11/h3-6H,2H2,1H3,(H2,10,11)
InChIKey
SBNKFTQSBPKMBZ-UHFFFAOYSA-N
SMILES
C(N)(=O)C1=CC=CC=C1OCC
CAS DataBase Reference
938 · 938-73-8(CAS DataBase Reference)
EWG's Food Scores
1 · 1
FDA UNII
929 ZCK4BF · L929ZCK4BF
ATC code
2 BA07 · N02BA07
NIST Chemistry Reference
Ethenzamide(938-73-8)
EPA Substance Registry System
Ethenzamide (938-73-8)
UNSPSC Code
12352100 · 12352100
NACRES
22 · NA.22
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
303 · H303
Precautionary statements
270 · P270-P301+P312-P403-P501c
PPE
95 · Eyeshields, Gloves, type N95 (US)
Safety Statements
24 · 24/25
WGK Germany
2 · 2
RTECS
4381000 · CU4381000
TSCA
TSCA listed
HS Code
29242995 · 29242995
Storage Class
11 · 11 - Combustible Solids
Toxicity
50 orally · LD50 orally in mice: 1160 mg/kg (Starmer)

Safety & protection

Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid · 1 item

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. If symptoms (such as redness or irritation) develop, immediately transport the victim to a hospital.

Nonfire Spill Response · 1 item

SMALL SPILLS AND LEAKAGE: Should a spill occur while you are handling this chemical, FIRST REMOVE ALL SOURCES OF IGNITION, then you should dampen the solid spill material with 60-70% ethanol and transfer the dampened material to a suitable container. Use absorbent paper dampened with 60-70% ethanol to pick up any remaining material. Seal the absorbent paper, and any of your clothes, which may be contaminated, in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with 60-70% ethanol followed by washing with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.

Personal Protective Equipment (PPE) · 1 item

RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)

Safety data

PPE
Eyeshields, Gloves, type N95 (US)
wgk
2
tsca
TSCA listed
rtecs
CU4381000
hs_code
29242995
Toxicity
LD50 orally in mice: 1160 mg/kg (Starmer)
Signal word
Warning
Symbol(GHS)
GHS07
safety_code
24/25
Storage Class
11 - Combustible Solids
Hazard statements
H303
Precautionary statements
P270-P301+P312-P403-P501c
2-Ethoxybenzaldehyde
2'-Ethoxyacetophenone
2-Nitrobenzamide
4-Ethoxybenzamide
2-Fluorobenzamide
2-Ethoxybenzonitrile
Salicylhydrazide
Phenetole
Salicylaldoxime

Downstream products

2-Ethoxybenzoic acid

Suppliers100 total

北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
宁波君龙新材料有限公司0574 88552218 18969899212 · [email protected]
艾吉析科技(上海)有限公司17717235263 · [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]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
广州隽唐科技有限公司020-36607679 13502246435 · [email protected]
淮安嘉目生物科技有限公司0517-83187139 18205232085 · [email protected]
Syntechem Co.,Ltd[email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
阿法埃莎(中国)化学有限公司400-6106006 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
郑州研德生物科技有限公司0371-63682289 15538176268 · [email protected]
MedChemexpress LLC021-58955995 · [email protected]
贵州迪大科技有限责任公司0851-8475-2296 18096062265 · [email protected]
ChemeGen 中国18818260767 · [email protected]
玛雅试剂+86 (573) 82222445 (0)18006601000 452520369 · [email protected]
上海耐士化工科技有限公司400-188-0725 +86 21 34310725 13611771617
天津希恩思生化科技有限公司400 638 7771 · [email protected]
湖南汇百侍生物科技有限公司0731-85526065 13308475853 · [email protected]
赛默飞世尔科技(中国)有限公司800-810-5118 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
广州爱纯医药科技有限公司020-39119399 18927568969 · [email protected]
苏州亚科科技股份有限公司0512-87182055 13451648594 · [email protected]
HBCChem, Inc.+1-510-219-6317 · [email protected]
北京奥秘佳得医药科技有限公司+86-13522808617 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
阳谷荣科商贸有限公司15863541132 · [email protected]
杭州杰恒化工有限公司0571-87396432 · [email protected]
湖北巨胜科技有限公司027-59599241 18871490274 · [email protected]
池州凯隆进出口贸易有限公司[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]
天津阿尔塔科技有限公司022-6537-8550 15522853686 · [email protected]
TargetMol中国(陶术生物)021-021-33632979 15002134094 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
上海博熠生物医药科技有限公司021-021-54331997 18321536537 · [email protected]

Additional notes

DefinitionChEBI: Ethenzamide is an organic molecular entity.