- 6-Fluoro-3-(4-piperidinyl)-1,2-benzisoxazole
- 6-Fluoro-3-(4-piperidinyl)-1,2-benzisoxazole hydrochloride
- 84166-37-07,10,13-Trioxa-4-azahexadecan-1-aminium,N,N-diethyl-6,8,8,9,11,11,12,14,14,15,15,16,16,16-tetradecafluoro-N-methyl-5-oxo-6,9,12-tris(trifluoromethyl)-,iodide (1:1)
- 84167-74-8Ethanone,1-(5-bromo-6-methoxy-2-naphthalenyl)-
- 841-67-81H-Isoindole-1,3(2H)-dione,2-[(3S)-2,6-dioxo-3-piperidinyl]-
- 84170-03-62,7-Naphthalenedisulfonicacid,4-amino-6-[2-[4-[2-(2,4-diaminophenyl)diazenyl]phenyl]diazenyl]-5-hydroxy-3-[2-(4-nitrophenyl)diazenyl]-,sodium salt (1:2)
- 84170-74-1Poly[oxy(methyl-1,2-ethanediyl)],a,a'-(2,2-dimethyl-1,3-propanediyl)bis[w-[(1-oxo-2-propen-1-yl)oxy]-
- 84-17-3Phenol,4,4'-(1,2-diethylidene-1,2-ethanediyl)bis-
- 84174-62-94-Chloro-7-hydroxy-1-indanone oxime 97%
- 84176-63-64-Methylpyridinium decyl sulphate
- 841-77-0Piperazine,1-(diphenylmethyl)-
- 84182-46-71,1-Cyclobutanedicarboxylicacid, 3-(phenylmethoxy)-
Hot Products
- 104987-11-3Tacrolimus
- 141-53-7Sodium formate
- 8001-54-5Quaternary ammonium compounds, alkylbenzyldimethyl, chlorides
- 9003-39-8Povidone
- 10161-34-9Trenbolone acetate
- 402957-28-2Telaprevir
- 68-19-9Cyanocobalamin
- 7631-86-9Silicon dioxide
- 302-79-4Tretinoin
- 77-92-9Citric acid
|
Basic Information |
|
Post buying leads |
|
Suppliers |
|
Cas Database |
| Name |
6-Fluoro-3-(4-piperidinyl)-1,2-benzisoxazole |
EINECS | 617-540-3 |
| CAS No. | 84163-77-9 | Density | 1.216 g/cm3 |
| PSA | 38.06000 | LogP | 2.76270 |
| Solubility | N/A | Melting Point |
59-62 °C |
| Formula | C12H13FN2O | Boiling Point | 359 °C at 760 mmHg |
| Molecular Weight | 220.246 | Flash Point | 170.9 °C |
| Transport Information | N/A | Appearance | white crystalline powder |
| Safety | 45-26 | Risk Codes | 25-36/37/38 |
| Molecular Structure |
|
Hazard Symbols | T |
| Synonyms |
3-(4-Piperidinyl)-6-fluorobenzo[d]isoxazole;4-(6-Fluoro-1,2-benzisoxazol-3-yl)piperidine;4-(6-Fluorobenzo[d]isoxazol-3-yl)piperidine;6-Fluoro-3-(4-piperidinyl)benzisoxazole;6-Fluoro-3-(piperidin-4-yl)benzo[d]isoxazole;R 56109; |
Article Data | 20 |
6-Fluoro-3-(4-piperidinyl)-1,2-benzisoxazole Specification
The IUPAC name of 1,2-Benzisoxazole,6-fluoro-3-(4-piperidinyl)- is 6-fluoro-3-piperidin-4-yl-1,2-benzoxazole. With the CAS registry number 84163-77-9, it is also named as 4-(6-Fluoro-1,2-benzisoxazol-3-yl)piperidine. The product's categories are API Intermediates; Heterocyclic Compounds; Heterocycles; Pharmaceutical. It is white crystalline powder which is used as pharmaceutical intermediate.
The other characteristics of 1,2-Benzisoxazole,6-fluoro-3-(4-piperidinyl)- can be summarized as: (1)ACD/LogP: 1.85; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 29.27 Å2; (7)Index of Refraction: 1.566; (8)Molar Refractivity: 59.07 cm3; (9)Molar Volume: 181 cm3; (10)Polarizability: 23.42×10-24 cm3; (11)Surface Tension: 43.7 dyne/cm; (12)Density: 1.216 g/cm3; (13)Flash Point: 170.9 °C; (14)Enthalpy of Vaporization: 60.45 kJ/mol; (15)Boiling Point: 359 °C at 760 mmHg; (16)Vapour Pressure: 2.46E-05 mmHg at 25°C; (17)Rotatable Bond Count: 1; (18)Exact Mass: 220.101191; (19)MonoIsotopic Mass: 220.101191; (20)Topological Polar Surface Area: 38.1; (21)Heavy Atom Count: 16; (22)Complexity: 245.
People can use the following data to convert to the molecule structure.
1. SMILES:Fc3ccc1c(onc1C2CCNCC2)c3
2. InChI:InChI=1/C12H13FN2O/c13-9-1-2-10-11(7-9)16-15-12(10)8-3-5-14-6-4-8/h1-2,7-8,14H,3-6H2
3. InChIKey:MRMGJMGHPJZSAE-UHFFFAOYAH
4. Std. InChI:InChI=1S/C12H13FN2O/c13-9-1-2-10-11(7-9)16-15-12(10)8-3-5-14-6-4-8/h1-2,7-8,14H,3-6H2
5. Std. InChIKey:MRMGJMGHPJZSAE-UHFFFAOYSA-N
What can I do for you?
Get Best Price
