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| CAS No.: | 382-67-2 |
|---|---|
| Name: | Pregna-1,4-diene-3,20-dione,9-fluoro-11,21-dihydroxy-16-methyl-, (11b,16a)- |
| Article Data: | 6 |
| Cas Database | |
| Molecular Structure: | |
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| Formula: | C22H29FO4 |
| Molecular Weight: | 376.468 |
| Synonyms: | 17-Deoxymethansone;9-Fluoro-11-beta,21-dihydroxy-16-alpha-methylpregna-1,4-diene-3,20-dione;A 41-304;A 41304;BRN 2228097;Esperson; |
| EINECS: | 206-845-3 |
| Density: | 1.25 g/cm3 |
| Melting Point: | 217oC |
| Boiling Point: | 532.3 °C at 760 mmHg |
| Flash Point: | 275.7 °C |
| Solubility: | N/A |
| Appearance: | N/A |
| Hazard Symbols: |
 Xn
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| Risk Codes: | 20/21/22-36/37/38-40-43 |
| Safety: | 22-26-36 |
| Transport Information: | N/A |
| PSA: | 74.60000 |
| LogP: | 2.78080 |
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The Desoximetasone with cas registry number of 382-67-2 is a kind of Steroids. It is also known as Esperson; Flubason; HOE 304; Ibaril; R 2113; Stiedex; Topicort; Topicort LP; Topisolon; UNII-4E07GXB7AU; 21-Desoxybetamethasone; 9-Fluoro-11b,21-dihydroxy-16a-methylpregna-1,4-diene-3,20-dione. Its systematic name is called (16alpha)-9-fluoro-11,21-dihydroxy-16-methylpregna-1,4-diene-3,20-dione. Its EINECS registry number is 206-845-3. This compound is a topical anti-inflammatory glucocorticoid used in DERMATOSES, skin allergies, PSORIASIS, etc.
Physical properties about this chemical are: (1)ACD/LogP: 2.22 ; (2)# of Rule of 5 Violations: 0 ; (3)ACD/LogD (pH 5.5): 2 ; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 28; (6)ACD/BCF (pH 7.4): 28; (7)ACD/KOC (pH 5.5): 375; (8)ACD/KOC (pH 7.4): 375; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12) Polar Surface Area: 74.6 Å2; (13)Index of Refraction: 1.574; (14)Molar Refractivity: 98.672 cm3; (15)Molar Volume: 299.112 cm3; (16)Surface Tension: 50.413 dyne/cm; (17)Density: 1.259 g/cm3; (18)Flash Point: 275.696 °C ; (19)Enthalpy of Vaporization: 92.934 kJ/mol; (20)Boiling Point: 532.251 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
An experimental teratogen. Other experimental reproductive effects. When heated to decomposition it emits toxic fumes of F-. This chemical is harmful by inhalation, in contact with skin and if swallowed and irritating to eyes, respiratory system and skin. May cause sensitization by skin contact. Wear suitable protective clothing and do not breathe dust during using it. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: OCC(=O)[C@H]4[C@H](C)C[C@@H]1[C@]4(C)CC(O)[C@]2(F)[C@@]3(C)/C=C\C(=O)/C=C3/CC[C@@H]12;
(2)InChI:InChI=1/C22H29FO4/c1-12-8-16-15-5-4-13-9-14(25)6-7-21(13,3)22(15,23)18(27)10-20(16,2)19(12)17(26)11-24/h6-7,9,12,15-16,18-19,24,27H,4-5,8,10-11H2,1-3H3/t12-,15+,16+,18?,19-,20+,21+,22+/m1/s1;
(3)InChIKey: VWVSBHGCDBMOOT-DPUKQCMYBZ
