Grundinformationen
- Standard-SMILES
CCCCOCCOCC(=O)O- InChIKey
MCORDGVZLPBVJB-UHFFFAOYSA-N- Summenformel
- C8H16O4
- Durchschnittliche Molmasse
- 176,21 g/mol
- Monoisotopische Masse
- 176,10485899
Namen und Bezeichner
- Bevorzugter Name
- 2-(2-Butoxyethoxy)acetic acid
- IUPAC
- 2-(2-butoxyethoxy)acetic acid
- Englischer Name
- (2-n-Butoxyethoxy)acetic acid
- Summenformel
- C8H16O4
- Molmasse
- 176.21
Namen und Synonyme
2-(2-butoxyethoxy)acetic Acid82941-26-2DTXSID601003011RefChem:84020DTXCID10198104MCORDGVZLPBVJB-UHFFFAOYSA-N(2-Butoxyethoxy)acetic Acid(2-N-BUTOXYETHOXY)ACETIC ACID3,6-Dioxadecanoic AcidMFCD01105178(2-Butoxyethoxy)acetic acid; (2-n-Butoxyethoxy)acetic acid; 3,6-Dioxadecanoic acidbutoxyethoxyacetic acid
Weitere Namen anzeigen
Butoxyethoxyaceticacid(2-Butoxyethoxy)aceticAcid>(2-n-Butoxyethoxy)acetic acidAcetic acid, 2-(2-butoxyethoxy)-
2-(2-butoxyethoxy)aceticAcidSCHEMBL1172491CHEBI:232969(2-Butoxyethoxy)acetic Acid , 98%AKOS005202853(2-Butoxyethoxy)acetic acid, AldrichCPRAS-61372SY052785
Datenbank-Bezeichner
- CAS
82941-26-2- PubChem CID
- 106312
- DTXSID
DTXSID601003011- ChEBI
CHEBI:232969- EC Number
- 451-650-0、679-845-8
- Nikkaji
- J3.654.969F
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 0,8
- Polarare Oberfläche (TPSA)
- 55,8 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 8
- Schwere Atome
- 12
- Formalladung
- 0
- Komplexität
- 114
Experimentelle und physikochemische Eigenschaften
Physical DescriptionLiquid
Physikochemische Eigenschaften
- Siedepunkt
- 141 °C · 141 °C / 5mmHg
- Dichte
- 1.05 · 1.05
- Brechungsindex
- 1.436 to · 1.4360 to 1.4400
- storage temp.
- Refrigerator, under inert atmosphere
- Löslichkeit
- Chloroform (Slightly), Methanol (Slightly)
- Aggregatzustand
- Oil
- pka
- 3.4 · 3.40±0.10(Predicted)
- Farbe
- Colourless
- InChI
- 1S/C8H16O4/c1-2-3-4-11-5-6-12-7-8(9)10/h2-7H2,1H3,(H,9,10)
- InChIKey
- MCORDGVZLPBVJB-UHFFFAOYSA-N
- SMILES
- CCCCOCCOCC(O)=O
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (50%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264, P264+P265, P280, P302+P352, P305+P351+P338, P305+P354+P338, P317, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 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
Acetic acid, 2-(2-butoxyethoxy)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Acetic acid, 2-(2-butoxyethoxy)- 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)
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Status: Active Update: 10-12-2010 https://echa.europa.eu/registration-dossier/-/registered-dossier/2597
Hazard Classes and Categories
Skin Corr. 1B (100%)；Eye Dam. 1 (100%)
Skin Irrit. 2 (50%)；Eye Dam. 1 (50%)；Eye Irrit. 2 (50%)
Regulatorische Informationen
Regulatory Information
Acetic acid, 2-(2-butoxyethoxy)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Acetic acid, 2-(2-butoxyethoxy)- 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)
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Status: Active Update: 10-12-2010 https://echa.europa.eu/registration-dossier/-/registered-dossier/2597
Sicherheitsdaten
- wgk
- WGK 3
- tsca
- TSCA listed
- hs_code
- 2918.19.9000
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Eye Dam. 1
Chemie und Industrie
Verwendung und Herstellung
U.S. Production2023: 46 lb；2020: 22,523 lb
Industry UsesEmulsifier
General Manufacturing Information
Primary Metal Manufacturing
Acetic acid, 2-(2-butoxyethoxy)-: ACTIVE
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