Ethyl-4-dimethylaminobenzoat

Ethyl 4-(dimethylamino)benzoate

HCID 25127CAS 10287-53-3
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Grundinformationen

Standard-SMILES
CCOC(=O)c1ccc(N(C)C)cc1
InChIKey
FZUGPQWGEGAKET-UHFFFAOYSA-N
Summenformel
C11H15NO2
Durchschnittliche Molmasse
193,24 g/mol
Monoisotopische Masse
193,11027872

Überblick

Parbenate is a benzoate ester that is ethyl benzoate substituted by a dimethylamino group at position 4. It is an ethyl ester, a benzoate ester and a tertiary amino compound.

Namen und Bezeichner

Bevorzugter Name
Ethyl 4-(dimethylamino)benzoate
IUPAC
ethyl 4-(dimethylamino)benzoate
Lokaler Name
Ethyl-4-dimethylaminobenzoat
Englischer Name
Ethyl 4-dimethylaminobenzoate
Summenformel
C11H15NO2
Molmasse
193.24

Namen und Synonyme

Ethyl 4-dimethylaminobenzoate10287-53-3ParbenateEthyl 4-(dimethylamino)benzoateKayacure EPABenzoic acid, 4-(dimethylamino)-, ethyl esterGenocure EPDDarocur EBDDTXSID2044763p-Dimethylaminobenzoic acid ethyl ester829S8D3Y0XPL-EDB
Weitere Namen anzeigen
EDBETHYL P-DIMETHYLAMINOBENZOATEp-DimethylaminobenzoatePI ED8PI-EDBAPi-EDB
DTXCID0024763CHEBI:520734-dimethylaminobenzoic acid ethyl esterRefChem:595408233-634-3N,N-DimethylbenzocaineEthyl-4-dimethylaminobenzoateSpeedcure EDB

Datenbank-Bezeichner

CAS
10287-53-3
PubChem CID
25127
DTXSID
DTXSID2044763
ChEMBL
CHEMBL3185245
ChEBI
CHEBI:52073
UNII
829S8D3Y0X
EC Number
233-634-3
Nikkaji
J92.469E

Eigenschaften

Berechnete Struktureigenschaften

XLogP
2,9
Polarare Oberfläche (TPSA)
29,5 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
3
Frei drehbare Bindungen
4
Schwere Atome
14

Experimentelle und physikochemische Eigenschaften

PolymersPlastics & Rubber -> Curing Agents (Aromatic)
CosmeticsPersonal care product
Physical Description · 2 Einträge

Dry Powder; Other Solid; Large Crystals

White crystalline powder; [Acros Organics MSDS]

Collision Cross Section149.3 Ų [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: APCI+; Dataset: TOXCAST; Source Identifier: DTXSID2044763]

Physikochemische Eigenschaften

Schmelzpunkt
63 · 63-66 °C(lit.)
Siedepunkt
190 · 190-191°C 14mm
Dichte
1.06 · 1.06
Dampfdruck
0.593 Pa · 0.593Pa at 25℃
Brechungsindex
1.508 · 1.5080 (estimate)
Flammpunkt
190 · 190-191°C/14mm

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

This chemical does not meet GHS hazard criteria for 55.6% (144 of 259) of all reports.

Danger

H360 (18.5%): May damage fertility or the unborn child [Danger Reproductive toxicity]

P203, P273, P280, P318, P391, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 259 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Regulatory Information · 4 Einträge

Chemical: Benzoic acid, 4-(dimethylamino)-, ethyl ester

Benzoic acid, 4-(dimethylamino)-, ethyl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzoic acid, 4-(dimethylamino)-, ethyl ester are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Status: Active Update: 20-01-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/24038

Benzoic acid, 4-(dimethylamino)-, ethyl ester: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazards SummaryMay cause irritation; [Acros Organics MSDS]
Hazard Classes and CategoriesRepr. 1B (18.5%)

Sicherheitsdaten

wgk
3
tsca
TSCA listed
hs_code
29224995
risk_code
36/37/38
hazard_code
Xi
safety_code
37/39-26

Chemie und Industrie

Verwendung und Herstellung

UsesUsed as a polymerization accelerator; [ChemIDplus]
U.S. Production2023: 75,000 - <100,000 lb
Consumer UsesNot Known or Reasonably Ascertainable
Industry UsesNot Known or Reasonably Ascertainable
General Manufacturing Information · 2 Einträge

Printing Ink Manufacturing

Benzoic acid, 4-(dimethylamino)-, ethyl ester: ACTIVE

Anwendungen · 1 Eintrag

VerwendenEthyl 4-dimethylaminobenzoate is employed as a photoinititator in cell encapsulation applications. It is also useful for organic synthesis. Further, it is used in UV-curing coatings and inks for the initiation of photo polymerization of unsaturated prepolymers. In addition to this, it acts as a active pharmaceutical ingredient intermediate. It can also be used as a co-initiator with camphorquinone (CQ) to form a self-adhesive composite for the fabrication of photosensitizers in dental materials.

Vor- und nachgelagerte Produkte

Anbieter50 Anbieter

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]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
河南赢创生物科技有限公司16650615803 · [email protected]
北京安司莫森技术有限公司010-82954736 13391601435 · [email protected]

Ergänzende Hinweise

DefinitionChEBI: A benzoate ester that is ethyl benzoate substituted by a dimethylamino group at position 4.

Zugehörige Reaktionen

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Verknüpfte Notizen

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