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| Name |
Monochlorophenylxylylethane |
EINECS | N/A |
| CAS No. | 95719-24-7 | Density | 1.061g/cm3 |
| PSA | 0.00000 | LogP | 5.10860 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C16H17Cl | Boiling Point | 341.2°C at 760 mmHg |
| Molecular Weight | 244.78 | Flash Point | 144.6°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Moderately toxic by ingestion. Experimental reproductive effects. When heated to decomposition it emits toxic vapors of Cl−. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Chlorodimethyl(1-phenylethyl)benzene;Benzene,chlorodimethyl(1-phenylethyl);Monochlorophenylxylylethane;1,1-Phenylmonochloroxylylethane; |
Monochlorophenylxylylethane Chemical Properties
Molecule structure of Monochlorophenylxylylethane (CAS NO.95719-24-7):
IUPAC Name: 1-Chloro-2,3-dimethyl-4-(1-phenylethyl)benzene
Molecular Weight: 244.75918 g/mol
Molecular Formula: C16H17Cl
Density: 1.061 g/cm3
Boiling Point: 341.2 °C at 760 mmHg
Flash Point: 144.6 °C
Index of Refraction: 1.561
Molar Refractivity: 74.74 cm3
Molar Volume: 230.5 cm3
Polarizability: 29.63×10-24 cm3
Surface Tension: 36.7 dyne/cm
Enthalpy of Vaporization: 56.17 kJ/mol
Vapour Pressure: 0.000161 mmHg at 25 °C
XLogP3-AA: 5.5
Rotatable Bond Count: 2
Exact Mass: 244.101878
MonoIsotopic Mass: 244.101878
Heavy Atom Count: 17
Complexity: 232
Canonical SMILES: CC1=C(C=CC(=C1C)Cl)C(C)C2=CC=CC=C2
InChI: InChI=1S/C16H17Cl/c1-11-12(2)16(17)10-9-15(11)13(3)14-7-5-4-6-8-14/h4-10,13H,1-3H3
InChIKey of Monochlorophenylxylylethane (CAS NO.95719-24-7): JVZOSCNIJORZIZ-UHFFFAOYSA-N
Monochlorophenylxylylethane Toxicity Data With Reference
| 1. | orl-rat LD50:2129 mg/kg | GISAAA Gigiena i Sanitariya. 58 (1)(1993),30. | ||
| 2. | orl-mus LD50:1488 mg/kg | GISAAA Gigiena i Sanitariya. 58 (1)(1993),30. |
Monochlorophenylxylylethane Safety Profile
Moderately toxic by ingestion. Experimental reproductive effects. When heated to decomposition it emits toxic vapors of Cl−.
Monochlorophenylxylylethane Specification
Monochlorophenylxylylethane (CAS NO.95719-24-7) is also named as 1,1-Phenylmonochloroxylylethane ; Chlorodimethyl(1-phenylethyl)benzene ; Xylene, chloro(alpha-methylbenzyl)- ; Benzene, chlorodimethyl(1-phenylethyl)- .
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