Grundinformationen
- Standard-SMILES
C=Cc1ccc(COC(C)=O)cc1- InChIKey
LEIKPUSDAWATBV-UHFFFAOYSA-N- Summenformel
- C11H12O2
- Durchschnittliche Molmasse
- 176,21 g/mol
- Monoisotopische Masse
- 176,08372962
Namen und Bezeichner
- Bevorzugter Name
- 4-Vinylbenzyl acetate
- IUPAC
- (4-ethenylphenyl)methyl acetate
- Englischer Name
- 4-Vinylbenzyl acetate
- Summenformel
- C11H12O2
- Molmasse
- 176.21
Namen und Synonyme
4-VINYLBENZYL ACETATE1592-12-7DTXSID20370611RefChem:527095DTXCID40321645695-183-2(4-ethenylphenyl)methyl acetateMFCD00078265(4-vinylphenyl)methyl acetatep-acetoxymethylstyrene4-ethenylbenzenemethanol acetateSCHEMBL1051823
Weitere Namen anzeigen
Vinylbenzyl acetate4-Vinylbenzyl alcohol acetate4-VINYLBENZYL ACETATE STABILIZED 95%4-Vinylbenzyl acetate, 95%, stabilizedBenzenemethanol, 4-ethenyl-, 1-acetate4-Vinylbenzyl acetate, stabilized, 95%4-Vinylbenzyl acetate, stabilized, 95% 5GR
AKOS016008947AS-48046SY240133ST50405736F17591F814547
Datenbank-Bezeichner
- CAS
1592-12-7- PubChem CID
- 2735161
- DTXSID
DTXSID20370611- EC Number
- 695-183-2
- Nikkaji
- J725.925E
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,9
- Polarare Oberfläche (TPSA)
- 26,3 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 13
- Formalladung
- 0
- Komplexität
- 179
Physikochemische Eigenschaften
- Siedepunkt
- 125 °C/12mmHg · 125°C/12mmHg
- Dichte
- 1.051 g/cm3 · 1.051 g/cm3(Temp: 25 °C)
- Brechungsindex
- 1.535 · 1.535-1.538
- storage temp.
- 2 · Sealed in dry,2-8°C
- Aggregatzustand
- Crystals or Crystalline Powder
- Farbe
- White
- InChI
- InChI=1S/C11H12O2/c1-3-10-4-6-11(7-5-10)8-13-9(2)12/h3-7H,1,8H2,2H3
- InChIKey
- LEIKPUSDAWATBV-UHFFFAOYSA-N
- SMILES
- C1(COC(=O)C)C=CC(C=C)=CC=1
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Gefahrenhinweise
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Sicherheitsdaten
- hs_code
- 29163900
- safety_code
- 24/25
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