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| CAS No.: | 86608-70-0 |
|---|---|
| Name: | 2-(1,3-Dioxolan-2-yl)ethyltriphenylphosphonium bromide |
| Article Data: | 4 |
| Molecular Structure: | |
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|
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| Formula: | C23H24 O2 P . Br |
| Molecular Weight: | 443.32 |
| Synonyms: | Phosphonium,[2-(1,3-dioxolan-2-yl)ethyl]triphenyl-, bromide (9CI); 2-(3,3-Dioxolan-2-yl)ethyltriphenylphosphoniumbromide; [2-(1,3-Dioxolan-2-yl)ethyl]triphenylphosphonium bromide;[2-(1,3-Dioxolan-2-yl)ethyl]triphosphonium bromide |
| Melting Point: | 144-146 ºC |
| Appearance: | Pale yellow powder |
| Hazard Symbols: |
|
| Risk Codes: | R22;R33;R41;R52/53 |
| Safety: | 5209374 |
| PSA: | 32.05000 |
| LogP: | 0.74750 |
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Chemistry
IUPAC Name: 2-(1,3-Dioxolan-2-yl)ethyl-triphenylphosphanium bromide
Systematic of 2-(1,3-Dioxolan-2-yl)ethyltriphenylphosphonium bromide (CAS NO.86608-70-0): Phosphonium, (2-(1,3-dioxolan-2-yl)ethyl)triphenyl-, bromide (1:1)
CAS NO: 86608-70-0
Classification Code: TSCA Flag P [A commenced PMN (Premanufacture Notice) substance]
Molecular Formula of 2-(1,3-Dioxolan-2-yl)ethyltriphenylphosphonium bromide (CAS NO.86608-70-0): C23H24BrO2P
Molecular Weight: 443.3132
Molecular Structure:
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Melting Point of 2-(1,3-Dioxolan-2-yl)ethyltriphenylphosphonium bromide (CAS NO.86608-70-0): 144-146 °C
H bond acceptors: 2
Freely Rotating Bonds: 6
Polar Surface Area: 18.46 Å2
SMILES: [Br-].O1CCOC1CC[P+](c2ccccc2)(c3ccccc3)c4ccccc4
InChI: InChI=1/C23H24O2P.BrH/c1-4-10-20(11-5-1)26(21-12-6-2-7-13-21,22-14-8-3-9-15-22)19-16-23-24-17-18-25-23;/h1-15,23H,16-19H2;1H/q+1;/p-1
InChIKey: ZCJKBPSRKLHANV-REWHXWOFAM
Std. InChI: InChI=1S/C23H24O2P.BrH/c1-4-10-20(11-5-1)26(21-12-6-2-7-13-21,22-14-8-3-9-15-22)19-16-23-24-17-18-25-23;/h1-15,23H,16-19H2;1H/q+1;/p-1
Std. InChIKey: ZCJKBPSRKLHANV-UHFFFAOYSA-M
Safety Profile
Hazard Codes: 
Xn
Risk Statements: 22-33-41-52/53
R22: Harmful if swallowed.
R33: Danger of cumulative effects.
R41: Risk of serious damage to the eyes.
R52/53: Harmful to aquatic organisms, may cause long-term adverse effects in the aquatic environment.
Safety Statements: 22-26-39-61
S22: Do not breathe dust.
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S39: Wear eye / face protection.
S61: Avoid release to the environment. Refer to special instructions / safety data sheets.
WGK Germany: 2
F: 3