Products Categories
| CAS No.: | 88224-05-9 |
|---|---|
| Name: | L-Isoleucine allyl ester p-toluenesulfonate salt |
| Molecular Structure: | |
|
|
|
| Formula: | C9H17NO2.C7H8O3S |
| Molecular Weight: | 343.444 |
| Synonyms: | H-lle-OAll TosOH;H-Ile-OAll·TosOH; |
| Boiling Point: | 487.3 °C at 760 mmHg |
| Flash Point: | 248.5 °C |
| PSA: | 115.07000 |
| LogP: | 4.11180 |
- 958254-66-51H-Imidazo[4,5-b]pyridine-2-carboxaldehyde, 1-methyl-, hydrochloride
- 99170-93-1N-Methyl-2-oxazolamine
- 914458-26-7[5-(2-fluorophenyl)-1-pentyl-1H-pyrrol-3-yl]-1-naphthalenyl-Methanone
- 894852-01-87-BROMO-2,2-DIMETHYL-2H-PYRIDO[3,2-B][1,4]OXAZIN-3(4H)-ONE
- 90221-55-92-bromo-5-methylbenzaldehyde
- 885590-99-82,3-DIFLUORO-4-IODOBENZALDEHYDE
- 97730-31-9(S)-4'-(2-Methylbutyl)Biphenyl-4-Carbonitrile
- 926293-55-26-Bromo-2-methylpyridine-3-carboxaldehyde
- 911112-05-55-Iodo-3-(trifluoromethyl)-2-pyridinamine
- 886364-50-71-(5-Bromo-2-pyridinyl)-2,2,2-trifluoroethanone
- Total:33 Page 1 of 1 1
What can I do for you?
Get Best Price
Specification
The L-Isoleucine allyl ester p-toluenesulfonate salt, with the CAS registry number 88224-05-9, is also known as H-Ile-OAll·TosOH. It belongs to the product categories of Isoleucine [Ile, I]; Amino Acids and Derivatives; Amino Acids; I - Z and Modified Amino Acids. This chemical's molecular formula is C16H25NO5S and molecular weight is 343.44. What's more, its IUPAC name is 4-Methylbenzenesulfonic acid; Prop-2-enyl 2-amino-3-methylpentanoate and systematic name is called Allyl (2S,3S)-2-amino-3-methyl-pentanoate; 4-Methylbenzenesulfonic acid.
Physical properties about L-Isoleucine allyl ester p-toluenesulfonate salt are: (1) ACD/LogP: 2.74; (2) # of Rule of 5 Violations: 0; (3) ACD/LogD (pH 5.5): 0.24; (4) ACD/LogD (pH 7.4): 0.14; (5) #H bond acceptors: 6; (6)#H bond donors: 3; (7) #Freely Rotating Bonds: 8; (8) Polar Surface Area: 115.07 Å2; (9) Flash Point: 248.5 °C; (10) Enthalpy of Vaporization: 79.33 kJ/mol; (11) Boiling Point: 487.3 °C at 760 mmHg; (12) Vapour Pressure: 2.61E-10 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=S(O)(=O)c1ccc(C)cc1.C[C@@H](CC)[C@H](N)C(=O)OCC=C
(2) InChI: InChI=1/C9H17NO2.C7H8O3S/c1-4-6-12-9(11)8(10)7(3)5-2;1-6-2-4-7(5-3-6)11(8,9)10/h4,7-8H,1,5-6,10H2,2-3H3;2-5H,1H3,(H,8,9,10)/t7-,8-;/m0./s1
(3) InChIKey: KLSHVPHGOQRRIE-WSZWBAFRBH