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| CAS No.: | 84852-15-3 |
|---|---|
| Name: | NONYLPHENOL |
| Molecular Structure: | |
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|
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| Formula: | C15H24O |
| Molecular Weight: | 220.39 |
| Synonyms: | Phenol, 4-nonyl-, branched; |
| EINECS: | 203-199-4 |
| Density: | 0.937 g/mL at 25 °C(lit.) |
| Melting Point: | 56.34°C (estimate) |
| Boiling Point: | 293 °C |
| Flash Point: | 150 °C |
| Solubility: | 5g/L |
| Appearance: | clear viscous liquid |
| Hazard Symbols: |
 C
|
| Risk Codes: | 22-34 |
| Safety: | 26-36/37/39-45 |
| PSA: | 20.23000 |
| LogP: | 4.68530 |
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- Total:32 Page 1 of 1 1
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Specification
The p-Nonylphenol, branched, with the CAS registry number 84852-15-3, is also known as Phenol, 4-nonyl-, branched. It belongs to the product categories of Alkylphenols (Environmental Endocrine Disruptors); Analytical Chemistry; Environmental Endocrine Disruptors; Organic Building Blocks; Oxygen Compounds; Phenols; Alpha sort; N; NJ - NZ; N-PAlphabetic; Pesticides & Metabolites. Its EINECS registry number is 203-199-4. This chemical's molecular formula is C15H24O and molecular weight is 220.35046. Its IUPAC name is called . This chemical's classification codes are Reproductive Effect; Skin / Eye Irritant; TSCA UVCB. It is clear viscous liquid.
Physical properties of p-Nonylphenol, branched: (1)ACD/LogP: 6.01; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 1; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 8; (6)Index of Refraction: 1.504; (7)Molar Refractivity: 70.07 cm3; (8)Molar Volume: 236.6 cm3; (9)Surface Tension: 34.8 dyne/cm; (10)Density: 0.931 g/cm3; (11)Flash Point: 167.8 °C; (12)Enthalpy of Vaporization: 59 kJ/mol; (13)Boiling Point: 325.3 °C at 760 mmHg; (14)Vapour Pressure: 0.000122 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical may destroy living tissue on contact and may cause burns. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.
You can still convert the following datas into molecular structure:
(1)SMILES: Oc1ccc(cc1)CCCCCCC(C)C
(2)InChI: InChI=1/C15H24O/c1-13(2)7-5-3-4-6-8-14-9-11-15(16)12-10-14/h9-13,16H,3-8H2,1-2H3
(3)InChIKey: JSFITYFUKSFPBZ-UHFFFAOYAL
The toxicity data is as follows:
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| rabbit | LDLo | skin | 3160mg/kg (3160mg/kg) | GASTROINTESTINAL: OTHER CHANGES LIVER: OTHER CHANGES | Acute Toxicity Data. Journal of the American College of Toxicology, Part B. Vol. 1, Pg. 70, 1990. |
| rat | LD50 | oral | 1300mg/kg (1300mg/kg) | LIVER: OTHER CHANGES BLOOD: HEMORRHAGE | Acute Toxicity Data. Journal of the American College of Toxicology, Part B. Vol. 1, Pg. 70, 1990. |