Basic Information | Post buying leads | Suppliers |
Name |
3-Cyclopentane-D-alanine |
EINECS | 145-596-9 |
CAS No. | 99295-81-5 | Density | 1.111 g/cm3 |
PSA | 63.32000 | LogP | 1.67890 |
Solubility | N/A | Melting Point |
N/A |
Formula | C8H15NO2 | Boiling Point | 290.5 °C at 760 mmHg |
Molecular Weight | 157.213 | Flash Point | 129.5 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Cyclopentanepropanoicacid, a-amino-, (R)-;(R)-2-Amino-3-cyclopentylpropanoic acid;(R)-2-Amino-3-cyclopentylpropionicacid; |
The systematic name of 3-Cyclopentane-D-alanine is (2R)-2-ammonio-3-cyclopentylpropanoate. With the CAS registry number 99295-81-5, it is also named as Cyclopentanepropanoicacid, a-amino-, (R)-. The product's categories are Amino Acids; Amino Acid Derivatives. In addition, its molecular formula is C8H15NO2 and molecular weight is 157.21.
The other characteristics of 3-Cyclopentane-D-alanine can be summarized as: (1)ACD/LogP: 1.35; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 37.3 Å2; (7)Index of Refraction: 1.506; (8)Molar Refractivity: 42.07 cm3; (9)Molar Volume: 141.4 cm3; (10)Polarizability: 16.68×10-24cm3; (11)Surface Tension: 47.9 dyne/cm; (12)Density: 1.111 g/cm3; (13)Flash Point: 129.5 °C; (14)Enthalpy of Vaporization: 58.3 kJ/mol; (15)Boiling Point: 290.5 °C at 760 mmHg; (16)Vapour Pressure: 0.000516 mmHg at 25 °C.
People can use the following data to convert to the molecule structure.
(1)SMILES: O=C([O-])[C@@H](CC1CCCC1)[NH3+]
(2)InChI: InChI=1/C8H15NO2/c9-7(8(10)11)5-6-3-1-2-4-6/h6-7H,1-5,9H2,(H,10,11)/t7-/m1/s1
(3)InChIKey: KDYAKYRBGLKMAK-SSDOTTSWBF
(4)Std. InChI: InChI=1S/C8H15NO2/c9-7(8(10)11)5-6-3-1-2-4-6/h6-7H,1-5,9H2,(H,10,11)/t7-/m1/s1
(5)Std. InChIKey: KDYAKYRBGLKMAK-SSDOTTSWSA-N