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Grundinformationen
- CAS
33018-91-6- Standard-SMILES
CCOC(=O)CCCCCC(=O)O- InChIKey
NQYXFXWKKYGBNL-UHFFFAOYSA-N- Summenformel
- C9H16O4
- Durchschnittliche Molmasse
- 188,22 g/mol
- Monoisotopische Masse
- 188,10485899
Namen und Bezeichner
- Bevorzugter Name
- Ethyl hydrogen heptane-1,7-dioate
- IUPAC
- 7-ethoxy-7-oxoheptanoic acid
- Lokaler Name
- Ethylhydrogenheptan-1,7-dioat
- Englischer Name
- BOC-HIS(TOS)-MERRIFIELD RESIN
- Summenformel
- C9H16O4
- Molmasse
- 188.22
Namen und Synonyme
Ethyl hydrogen heptane-1,7-dioateEINECS 251-346-6RefChem:596215251-346-633018-91-67-ethoxy-7-oxoheptanoic acidMonoethyl PimelateEthyl Hydrogen PimelateHeptanedioic acid,1-ethyl esterPimelic Acid Monoethyl EsterHeptanedioic acid monoethyl esterMFCD00014383
Weitere Namen anzeigen
2-ethylheptanedioateMonoethylPimelate>BOC-HIS(TOS)-PAM RESINBOC-HIS(TOS)-BHA RESINBOC-HIS(TOS)-CMS RESINMonoethyl HeptanedioateBOC-HIS(TOS)-MBHA RESINpimelicacidmonethylesterBOC-HIS(TOS)-BHA PS RESIN
BOC-HIS(TOS)-MERRIFIELD RESINEthylhydrogen pimelateEthyl hydroden pimelate7-ethoxy-7-oxo-heptanoic acidorb1307351orb1940646SCHEMBL1115129DTXSID00871373
Datenbank-Bezeichner
- CAS
33018-91-6- PubChem CID
- 118383
- DTXSID
DTXSID00871373
Eigenschaften
Berechnete StruktureigenschaftenWird ergänzt
- XLogP
- 1,2
- Polarare Oberfläche (TPSA)
- 63,6 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 8
- Schwere Atome
- 13
- Formalladung
- 0
- Komplexität
- 165
Physikochemische Eigenschaften
- Schmelzpunkt
- 10 °C · 10°C
- Siedepunkt
- 135 · 135-138°C 1mm
- Dichte
- 1.06 · 1.06
- Brechungsindex
- 1.442 · 1.4420
- Flammpunkt
- 135 · 135-138°C/1mm
- storage temp.
- 2 · Sealed in dry,2-8°C
- pka
- 4.74 · 4.74±0.10(Predicted)
- Aggregatzustand
- powder to lump to clear liquid
- Farbe
- White or Colorless to Almost white or Almost colorless
- Wasserlöslichkeit
- Not miscible or difficult to mix with water.
- BRN
- 1774583 · 1774583
- InChI
- InChI=1S/C9H16O4/c1-2-13-9(12)7-5-3-4-6-8(10)11/h2-7H2,1H3,(H,10,11)
- InChIKey
- NQYXFXWKKYGBNL-UHFFFAOYSA-N
- SMILES
- C(OCC)(=O)CCCCCC(O)=O
- CAS Datenbank
- 33018 · 33018-91-6
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Danger
H302 (14.3%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (14.3%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H319 (85.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (28.6%): 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, P305+P354+P338, P317, 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 7 reports by companies from 4 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
Hazard Classes and CategoriesAcute Tox. 4 (14.3%)；Skin Irrit. 2 (100%)；Eye Dam. 1 (14.3%)；Eye Irrit. 2 (85.7%)；STOT SE 3 (28.6%)
Sicherheitsdaten
- wgk
- 3
- hs_code
- 2917.19.7050
- risk_code
- 36/38
- safety_code
- 26-36
Chemie und Industrie
Anwendungen
VerwendenEthyl hydrogen pimelate is an important raw material and intermediate used in organic synthesis, pharmaceuticals, agrochemicals and dyestuff fields.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Anbieter89 Anbieter
上海康恩博医药科技有限公司（科小研试剂）400-1388-521 17510465506 · [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]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
henan kanbei chemical co.,ltd+undefined-86-1523780-4566 +86-15237804566 · [email protected]
南京林叶化学试剂有限公司13376084917 13376082704 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Syntechem Co.,Ltd[email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
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