D-Cyclohexylalanine supplier | CasNO.58717-02-5

Name
H-D-CHA-OH
EINECS
CAS No. 58717-02-5
Article Data29
CAS DataBase
Density 1.075 g/cm³
Solubility
Melting Point 237 - 238 °C (H2O)
Formula C₉H₁₇NO₂
Boiling Point 307.1 °C at 760 mmHg
Molecular Weight 171.239
Flash Point 139.6 °C
Transport Information
Appearance
Safety 22-24/25
Risk Codes 22
Molecular Structure
Hazard Symbols Xn
Synonyms Cyclohexanepropanoicacid, a-amino-, (R)-;(2R)-2-Amino-3-cyclohexylpropanoic acid;D-3-Cyclohexylalanine;D-Cyclohexylalanine;
PSA 63.32000
LogP 2.06900

D-Cyclohexylalanine Specification

The CAS register number of Cyclohexanepropanoicacid, a-amino-, (aR)- is 58717-02-5. It also can be called as (2R)-2-Amino-3-cyclohexylpropanoic acid and the systematic name about this chemical is 3-cyclohexyl-D-alanine. The molecular formula about this chemical is C₉H₁₇NO₂and the molecular weight is 171.24. It belongs to the following product categories which include Peptide; Alanine Derivatives; Peptide Synthesis; Unnatural Amino Acid Derivatives and so on. When you are using it, please do not breathe dust and avoid contact with skin and eyes.

Physical properties about Cyclohexanepropanoicacid, a-amino-, (aR)- are: (1)ACD/LogP: 1.91 ; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 3; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 4; (9)Polar Surface Area: 29.54Å²; (10)Index of Refraction: 1.498; (11)Molar Refractivity: 46.68 cm³; (12)Molar Volume: 159.2 cm³; (13)Polarizability: 18.5x10^-24cm³; (14)Surface Tension: 45 dyne/cm; (15)Enthalpy of Vaporization: 60.24 kJ/mol; (16)Boiling Point: 307.1 °C at 760 mmHg; (17)Vapour Pressure: 0.000167 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)[C@H](N)CC1CCCCC1
(2)InChI: InChI=1/C9H17NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h7-8H,1-6,10H2,(H,11,12)/t8-/m1/s1
(3)InChIKey: ORQXBVXKBGUSBA-MRVPVSSYBT
(4)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-/m1/s1
(5)Std. InChIKey: ORQXBVXKBGUSBA-MRVPVSSYSA-N

Product Name

H-D-CHA-OH

D-Cyclohexylalanine Specification

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