2-Ethoxybenzoesure

2-Ethoxybenzoic acid

HCID 67252CAS 134-11-2

Grundinformationen

Standard-SMILES
CCOc1ccccc1C(=O)O
InChIKey
XDZMPRGFOOFSBL-UHFFFAOYSA-N
Summenformel
C9H10O3
Durchschnittliche Molmasse
166,17 g/mol
Monoisotopische Masse
166,06299418

Namen und Bezeichner

Bevorzugter Name
2-Ethoxybenzoic acid
IUPAC
2-ethoxybenzoic acid
Lokaler Name
2-Ethoxybenzoesure
Englischer Name
2-Ethoxybenzoic acid
Summenformel
C9H10O3
Molmasse
166.17

Namen und Synonyme

2-Ethoxybenzoic acid134-11-2o-Ethoxybenzoic acidBenzoic acid, 2-ethoxy-Benzoic acid, o-ethoxy-5IN9FDI7TTortho-Ethoxybenzoic acidNSC-406710DTXSID3059638RefChem:86834DTXCID2034176205-130-3
Weitere Namen anzeigen
AKOS BBB/2512-Ethoxybenzoic2-ethoxybenzoate2-Ethromycin acidRARECHEM AL BO 00302-ethoxy-benzoicaci2'-CarboxyphenetoleEugenol Impurity 19
MFCD00002438Benzoic acid, ethoxy-Ethoxybenzoic acid2-Ethoxybenzoic Acid; NSC 406710; o-Ethoxybenzoic Acid2-EthoxybenzoicacidEINECS 205-130-32-ethoxybenzoic-acidNSC 406710

Datenbank-Bezeichner

CAS
134-11-2
PubChem CID
67252
DTXSID
DTXSID3059638
ChEMBL
CHEMBL4303266
UNII
5IN9FDI7TT
EC Number
205-130-3
Nikkaji
J134.740C

Eigenschaften

Berechnete Struktureigenschaften

XLogP
2
Polarare Oberfläche (TPSA)
46,5 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
3
Frei drehbare Bindungen
3
Schwere Atome
12

Physikochemische Eigenschaften

Schmelzpunkt
19.3 · 19.3-19.5 °C (lit.)
Siedepunkt
174 · 174-176 °C/15 mmHg (lit.)
Dichte
1.105 g/mL · 1.105 g/mL at 25 °C (lit.)
Dampfdruck
0.281 Pa · 0.281Pa at 25℃
Brechungsindex
20 · n20/D 1.54(lit.)
Flammpunkt
230 °F · >230 °F

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302 (28.6%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (78.6%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (42.9%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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 14 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Gefahrenhinweise

Regulatory Information · 3 Einträge

Chemical: Benzoic acid, 2-ethoxy-

Status: Active Update: 13-09-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/18884;Status: Active Update: 19-08-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/32828

Benzoic acid, 2-ethoxy-: 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.

Hazard Classes and CategoriesAcute Tox. 4 (28.6%);Skin Irrit. 2 (78.6%);Eye Irrit. 2A (100%);STOT SE 3 (42.9%)

Regulatorische Informationen

Regulatory Information · 3 Einträge

Chemical: Benzoic acid, 2-ethoxy-

Status: Active Update: 13-09-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/18884;Status: Active Update: 19-08-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/32828

Benzoic acid, 2-ethoxy-: 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.

Sicherheitsdaten

wgk
3
tsca
TSCA listed
hs_code
29189900
risk_code
36/37/38-26-22
hazard_code
Xi,T
safety_code
23-24/25-45-36/37-28-26

Chemie und Industrie

Verwendung und Herstellung

General Manufacturing InformationBenzoic acid, 2-ethoxy-: ACTIVE
Anwendungen · 1 Eintrag

Verwenden2-Ethoxybenzoic acid is used in thermally induced solvent-free reactions of triphenylbismuth with a series of thiols and carboxylic acids. It serves as an active component of dental cement. Further, it prevents the entry of root-canal pathogens into periapical regions.

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