Grundinformationen
- Standard-SMILES
O=C(OCC1CCC(COC(=O)c2ccccc2)CC1)c1ccccc1- InChIKey
CVPZXHCZKMFVOZ-UHFFFAOYSA-N- Summenformel
- C22H24O4
- Durchschnittliche Molmasse
- 352,4 g/mol
- Monoisotopische Masse
- 352,16745924
Namen und Bezeichner
- Bevorzugter Name
- 1,4-Bis(benzoyloxymethyl)cyclohexane
- IUPAC
- [4-(benzoyloxymethyl)cyclohexyl]methyl benzoate
- Englischer Name
- 1,4-Cyclohexanedimethanol dibenzoate
- Summenformel
- C22H24O4
- Molmasse
- 352.42
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
35541-81-2- PubChem CID
- 118244
- DTXSID
DTXSID7041251- UNII
- 0NU241ECAO
- EC Number
- 416-230-3、609-138-1
- Nikkaji
- J1.022.679A
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 5
- Polarare Oberfläche (TPSA)
- 52,6 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 8
- Schwere Atome
- 26
- Formalladung
- 0
- Komplexität
- 399
Experimentelle und physikochemische Eigenschaften
Physikochemische Eigenschaften
- Schmelzpunkt
- 125 °C · 125 °C
- Siedepunkt
- 472.9 · 472.9±18.0 °C(Predicted)
- Dichte
- 1.125 · 1.125±0.06 g/cm3(Predicted)
- Kosmetik-Inhaltsstoffe Funktionen
- PLASTICISER
- LogP
- 6.049 · 6.049 (est)
- EPA chemische Informationen
- 1 · 1,4-Cyclohexanedimethanol, dibenzoate (35541-81-2)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
H413: May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]
P273, and P501 (click each P-code to see the statement)
H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]
P273, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 192 reports by companies from 1 notifications to the ECHA C&L Inventory.;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.
H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]
Gefahrenhinweise
Regulatory Information
Chemical: 1,4-Cyclohexanedimethanol, dibenzoate
1,4-Cyclohexanedimethanol, 1,4-dibenzoate is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,4-Cyclohexanedimethanol, 1,4-dibenzoate 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: 20-11-2012 https://echa.europa.eu/registration-dossier/-/registered-dossier/3506
1,4-Cyclohexanedimethanol, dibenzoate: 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 Categories
Aquatic Chronic 4 (100%)
Aquatic Chronic 4 (100%)
Hazardous to the aquatic environment (chronic) - category 4
Aquatic Chronic 4
Regulatorische Informationen
Regulatory Information
Chemical: 1,4-Cyclohexanedimethanol, dibenzoate
1,4-Cyclohexanedimethanol, 1,4-dibenzoate is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,4-Cyclohexanedimethanol, 1,4-dibenzoate 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: 20-11-2012 https://echa.europa.eu/registration-dossier/-/registered-dossier/3506
1,4-Cyclohexanedimethanol, dibenzoate: 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
- 1
- tsca
- TSCA listed
- risk_code
- 53
- safety_code
- 61
Chemie und Industrie
Verwendung und Herstellung
General Manufacturing Information
All Other Basic Organic Chemical Manufacturing
1,4-Cyclohexanedimethanol, 1,4-dibenzoate: ACTIVE
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