2,2'-[Oxybis(methylen)]bis[2-ethylpropan-1,3-diol]

Ditrimethylolpropane

HCID 90038
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Grundinformationen

CAS
23235-61-2
Standard-SMILES
CCC(CO)(CO)COCC(CC)(CO)CO
InChIKey
WMYINDVYGQKYMI-UHFFFAOYSA-N
Summenformel
C12H26O5
Durchschnittliche Molmasse
250,33 g/mol
Monoisotopische Masse
250,17802393

Namen und Bezeichner

Bevorzugter Name
Ditrimethylolpropane
IUPAC
2-[2,2-bis(hydroxymethyl)butoxymethyl]-2-ethylpropane-1,3-diol
Lokaler Name
2,2'-[Oxybis(methylen)]bis[2-ethylpropan-1,3-diol]
Englischer Name
Di(trimethylol propane)
Summenformel
C12H26O5
Molmasse
250.33

Namen und Synonyme

23235-61-2DitrimethylolpropaneDi-TrimethylolpropaneUNII-53E6MN32Z52,2'-(oxydimethanediyl)bis(2-ethylpropane-1,3-diol)DTXSID904487953E6MN32Z5EINECS 245-509-0EC 245-509-0BISTRIMETHYLOLPROPANEDITRIMETHYLOL PROPANEDTXCID7024879
Weitere Namen anzeigen
DTMPDI-TMPDitrimethylolDi(trimethylolpropane)>Bis(trihydroxymethyl)propane3,3,4-trimethyl-1,2-dioxetanePerstorp Di-TrimethylolpropaneBis (1,1,1-trimethylolpropane)
3,3,7,7-TETRAKIS(HYDROXYMETHYL)-5-OXANONANEBIS(1,1-DIMETHYLOLPROPYL)DIMETHYL ETHER2,2'-(OXYDIMETHYLENE)BIS(2-ETHYL-1,3-PROPANEDIOL)RefChem:135225245-509-0Di(trimethylolpropane)Di(trimethylol propane)2,2'-(Oxybis(methylene))bis(2-ethylpropane-1,3-diol)

Datenbank-Bezeichner

CAS
23235-61-2
PubChem CID
90038
DTXSID
DTXSID9044879
ChEMBL
CHEMBL3188200
UNII
53E6MN32Z5
EC Number
245-509-0
Nikkaji
J60.718E

Eigenschaften

Berechnete Struktureigenschaften

XLogP
-0,6
Polarare Oberfläche (TPSA)
90,2 Ų
H-Brücken-Donoren
4
H-Brücken-Akzeptoren
5
Frei drehbare Bindungen
10
Schwere Atome
17

Experimentelle und physikochemische Eigenschaften

Physical DescriptionDry Powder; CBI; Liquid
Collision Cross Section159.6 Ų [M+Na]+ [CCS Type: DT; Buffer gas: N2; Ionization: ESI+; Dataset: TOXCAST; Source Identifier: DTXSID9044879]

Physikochemische Eigenschaften

Schmelzpunkt
108 · 108-111 °C(lit.)
Siedepunkt
215 °C4 · 215 °C4 mm Hg(lit.)
Dichte
1.0187 · 1.0187 (rough estimate)
Dampfdruck
0 Pa · 0Pa at 25℃
Brechungsindex
1.456 · 1.4560 (estimate)
storage temp.
Store at room temperature

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 3 Einträge

This chemical does not meet GHS hazard criteria for 100% (272 of 272) of all reports.

Not Classified

Aggregated GHS information provided per 272 reports by companies from 2 notifications to the ECHA C&L Inventory.

Gefahrenhinweise

Regulatory Information · 4 Einträge

Chemical: 1,3-Propanediol, 2,2'-[oxybis(methylene)]bis[2-ethyl-

1,3-Propanediol, 2,2'-[oxybis(methylene)]bis[2-ethyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,3-Propanediol, 2,2'-[oxybis(methylene)]bis[2-ethyl- 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: 17-12-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/1913

1,3-Propanediol, 2,2'-[oxybis(methylene)]bis[2-ethyl-: 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 CategoriesNot Classified

Sicherheitsdaten

wgk
3
tsca
TSCA listed
hs_code
29094990
safety_code
22-24/25
Speicherklasse
13 - Non Combustible Solids

Chemie und Industrie

Verwendung und Herstellung

U.S. Production2023: 550,000 - <700,000 lb
Consumer UsesIntermediate
Industry UsesOther
General Manufacturing Information · 2 Einträge

All Other Basic Organic Chemical Manufacturing

1,3-Propanediol, 2,2'-[oxybis(methylene)]bis[2-ethyl-: ACTIVE

Anwendungen · 2 Einträge

BeschreibungDi(trimethylol propane), Di-TMP, 2,2-[oxybis(methylene)]-bis(2-ethyl)-1,3-propanediol is a colorless and crystalline substance (mp 112 – 114 ℃), only slightly soluble in water at ambient temperature (2.6 g/100 g at 25 ℃).It is a byproduct of 2-ethyl-2-hydroxymethyl-1,3-propanediol (TMP) production and can be isolated from the residue of the TMP distillation step. Newer investigations show that ditrimethylolpropane can be prepared in high yield and selectivity by the reaction of TMP, formaldehyde, and 2-ethylacrolein.

VerwendenDi(trimethylolpropane) can be used for the synthesis of lipase catalyzed hyperbranched polymers. It can also be used in the formation of biodegradable polymers for drug delivery applications.

Anbieter100 Anbieter

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]

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