Basic Information | Post buying leads | Suppliers |
Name |
(R)-3-Amino-4-(4-methylphenyl)butyric acid hydrochloride |
EINECS | N/A |
CAS No. | 177839-85-9 | Density | N/A |
PSA | 63.32000 | LogP | 2.84180 |
Solubility | N/A | Melting Point |
N/A |
Formula | C11H15NO2.HCl | Boiling Point | 374.9 °C at 760 mmHg |
Molecular Weight | 229.70 | Flash Point | 180.6 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
(R)-3-amino-4-(4-methyl-phenyl)-butyric acid-HCl;benzenebutanoic acid, beta-amino-4-methyl-, (betaR)-, hydrochloride (1:1); |
The (R)-3-Amino-4-(4-methylphenyl)butyric acid hydrochloride with the CAS number 177839-85-9 is also called (R)-3-amino-4-(4-methyl-phenyl)-butyric acid-HCl. Its molecular formula is C11H15NO2.HCl. This chemical belongs to the following product categories: (1)3-Amino-4-phenylbutanoic Acid Analogs; (2)B-Amino.
The properties of the chemical are: (1)ACD/LogP: 1.79; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 63.32Å2; (7)Flash Point: 180.6 °C; (8)Enthalpy of Vaporization: 65.66 kJ/mol; (9)Boiling Point: 374.9 °C at 760 mmHg; (10)Vapour Pressure: 2.75×10-6 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cl.N[C@H](Cc1ccc(C)cc1)CC(O)=O
(2)InChI: InChI=1/C11H15NO2.ClH/c1-8-2-4-9(5-3-8)6-10(12)7-11(13)14;/h2-5,10H,6-7,12H2,1H3,(H,13,14);1H/t10-;/m1./s1
(3)InChIKey: LUJTZKGPNYDSGW-HNCPQSOCBM