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Name |
L-Cyclohexylalanine |
EINECS | 1308068-626-2 |
CAS No. | 27527-05-5 | Density | 1.076 g/cm3 |
PSA | 63.32000 | LogP | 2.06900 |
Solubility | N/A | Melting Point |
322 °C |
Formula | C9H17NO2 | Boiling Point | 307.147 °C at 760 mmHg |
Molecular Weight | 171.239 | Flash Point | 139.558 °C |
Transport Information | N/A | Appearance | white to light yellow crystal powder |
Safety | 22-24/25-37/39-26 | Risk Codes | 36/37/38 |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
Cyclohexanepropionic acid, a-amino-, L- (8CI);Cyclohexanepropanoicacid, a-amino-, (S)-;(S)-b-Cyclohexylalanine;3-Cyclohexyl-L-alanine;3-Cyclohexylalanine;L-3-Cyclohexylalanine;b-Cyclohexyl-L-alanine;(S)-2-Amino-3-cyclohexylpropionic acid;(S)-(+)-a-Aminocyclohexanepropionic acid;(2S)-2-Amino-3-cyclohexylpropanoic acid; |
Article Data | 39 |
The L-Cyclohexylalanine, with the CAS registry number 27527-05-5, is also known as (S)-2-Amino-3-cyclohexylpropionic acid. It belongs to the product category of Chiral. This chemical's molecular formula is C9H17NO2 and molecular weight is 171.24. What's more, its systematic name is 3-Cyclohexyl-L-alanine. This chemical should be sealed and stored in a cool and dry place.
Physical properties of L-Cyclohexylalanine are: (1)ACD/LogP: 1.912; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.59; (4)ACD/LogD (pH 7.4): -0.59; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 1.00; (8)ACD/KOC (pH 7.4): 1.00; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 63.32 Å2; (13)Index of Refraction: 1.498; (14)Molar Refractivity: 46.688 cm3; (15)Molar Volume: 159.212 cm3; (16)Polarizability: 18.509×10-24cm3; (17)Surface Tension: 45 dyne/cm; (18)Density: 1.076 g/cm3; (19)Flash Point: 139.558 °C; (20)Enthalpy of Vaporization: 60.239 kJ/mol; (21)Boiling Point: 307.147 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. You should not breathe dust. When using it, you need wear suitable gloves and eye/face protection and must avoid contact with skin and eyes.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)[C@@H](N)CC1CCCCC1
(2)Std. InChI: InChI=1S/C9H17NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h7-8H,1-6,10H2,(H,11,12)/t8-/m0/s1
(3)Std. InChIKey: ORQXBVXKBGUSBA-QMMMGPOBSA-N