Basic Information | Post buying leads | Suppliers |
Name |
(R)-4-(1-Aminoethyl)phenol (S)-hydroxybutanedioate salt |
EINECS | N/A |
CAS No. | 134855-89-3 | Density | 1.096 g/cm3 |
PSA | 46.25000 | LogP | 2.11220 |
Solubility | N/A | Melting Point |
N/A |
Formula | C8H11NO.C4H6O5 | Boiling Point | 252.2 °C at 760 mmHg |
Molecular Weight | 271.27 | Flash Point | 106.3 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
4-[(1S)-1-Aminoethyl]phenol;(S)-1-(4-Hydroxyphenyl)ethylamine Bromide Salt; |
The (R)-4-(1-Aminoethyl)phenol (S)-hydroxybutanedioate salt, with CAS registry number of 134855-89-3, has the systematic name of 4-[(1S)-1-aminoethyl]phenol. And it is also called phenol, 4-[(1S)-1-aminoethyl]-.
Physical properties about this chemical are: (1)ACD/LogP: 0.70; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 46.25 Å2; (7)Index of Refraction: 1.572; (8)Molar Refractivity: 41.22 cm3; (9)Molar Volume: 125.1 cm3; (10)Polarizability: 16.34×10-24cm3; (11)Surface Tension: 46.4 dyne/cm; (12)Enthalpy of Vaporization: 50.93 kJ/mol; (13)Vapour Pressure: 0.0123 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: CC(c1ccc(cc1)O)N
(2)InChI: InChI=1/C8H11NO/c1-6(9)7-2-4-8(10)5-3-7/h2-6,10H,9H2,1H3/t6-/m0/s1
(3)InChIKey: CDQPLIAKRDYOCB-LURJTMIEBM
(4)Std. InChI: InChI=1S/C8H11NO/c1-6(9)7-2-4-8(10)5-3-7/h2-6,10H,9H2,1H3/t6-/m0/s1
(5)Std. InChIKey: CDQPLIAKRDYOCB-LURJTMIESA-N