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| CAS No.: | 613-31-0 |
|---|---|
| Name: | 9,10-DIHYDROANTHRACENE |
| Molecular Structure: | |
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| Formula: | C14H12 |
| Molecular Weight: | 180.249 |
| Synonyms: | 9,10-Dihydroanthracene;Dihydroanthracene;NSC 30805; |
| EINECS: | 210-336-1 |
| Density: | 1.085 g/cm3 |
| Melting Point: | 103-107 °C(lit.) |
| Boiling Point: | 305 °C at 760 mmHg |
| Flash Point: | 131.8 °C |
| Solubility: | 1.332mg/L(24.59 oC) |
| Appearance: | brown crystals |
| Hazard Symbols: |
 Xi
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| Risk Codes: | 36/37/38 |
| Safety: | 22-24/25-36/37-26 |
| PSA: | 0.00000 |
| LogP: | 3.18160 |
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Specification
This chemical is called 9,10-Dihydroanthracene, and its systematic name is 9,10-dihydroanthracene. With the molecular formula of C14H12, its product categories are Arenes; Building Blocks; Organic Building Blocks. The CAS registry number of this chemical is 613-31-0. In addition, this chemical should be sealed in the cool and dry place.
Other characteristics of the 9,10-Dihydroanthracene can be summarised as followings: (1)ACD/LogP: 4.16; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.16; (4)ACD/LogD (pH 7.4): 4.16; (5)ACD/BCF (pH 5.5): 853.28; (6)ACD/BCF (pH 7.4): 853.28; (7)ACD/KOC (pH 5.5): 4361.92; (8)ACD/KOC (pH 7.4): 4361.92; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Index of Refraction: 1.62; (13)Molar Refractivity: 58.4 cm3; (14)Molar Volume: 166 cm3; (15)Polarizability: 23.15×10-24cm3; (16)Surface Tension: 43.6 dyne/cm; (17)Density: 1.085 g/cm3; (18)Flash Point: 131.8 °C; (19)Enthalpy of Vaporization: 52.36 kJ/mol; (20)Boiling Point: 305 °C at 760 mmHg; (21)Vapour Pressure: 0.00152 mmHg at 25°C.
Production method of this chemical: The 9,10-Dihydroanthracene could be obtained by the reactant of 2-benzoyl-benzoic acid. This reaction needs the reagent of phosphorus, KI, phosphoric acid.
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Uses of this chemical: The 9,10-Dihydroanthracene could react with ethenetetracarbonitrile, and obtain the 9,10-dihydro-9,10-ethano-anthracene-11,11,12,12-tetracarbonitrile. This reaction needs the solvent of CH2Cl2. The yield is 100 %.
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When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing to avoid contacting with skin and eyes. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
1.SMILES: c1ccc3c(c1)Cc2c(cccc2)C3
2.InChI: InChI=1/C14H12/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h1-8H,9-10H2
3.InChIKey: WPDAVTSOEQEGMS-UHFFFAOYAH