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Phenol,3-[(1S)-1-aminoethyl]-

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Name

Phenol,3-[(1S)-1-aminoethyl]-

EINECS N/A
CAS No. 123982-81-0 Density 1.096 g/cm3
PSA 46.25000 LogP 2.11220
Solubility N/A Melting Point N/A
Formula C8H11NO Boiling Point 266.3 °C at 760 mmHg
Molecular Weight 137.181 Flash Point 114.9 °C
Transport Information N/A Appearance white like or light brown crystalline powder
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 123982-81-0 ((S)-3-(1-AMINO-ETHYL)-PHENOL) Hazard Symbols N/A
Synonyms

Phenol,3-(1-aminoethyl)-, (S)-;[(S)-1-(3-Hydroxyphenyl)ethyl]amine;

Article Data 10

Phenol,3-[(1S)-1-aminoethyl]- Specification

The Phenol,3-[(1S)-1-aminoethyl]- is an organic compound with the formula C8H11NO. The systematic name of this chemical is 3-[(1S)-1-aminoethyl]phenol. With the CAS registry number 123982-81-0, it is also named as (S)-3-(1-Amino-ethyl)-phenol. The product's category is Pharmacetical.

Physical properties about Phenol,3-[(1S)-1-aminoethyl]- are: (1)ACD/LogP: 0.70; (2)#H bond acceptors: 2; (3)#H bond donors: 3; (4)#Freely Rotating Bonds: 3; (5)Polar Surface Area: 46.25 Å2; (6)Index of Refraction: 1.572; (7)Molar Refractivity: 41.22 cm3; (8)Molar Volume: 125.1 cm3; (9)Polarizability: 16.34×10-24cm3; (10)Surface Tension: 46.4 dyne/cm; (11)Density: 1.096 g/cm3; (12)Flash Point: 114.9 °C; (13)Enthalpy of Vaporization: 52.46 kJ/mol; (14)Boiling Point: 266.3 °C at 760 mmHg; (15)Vapour Pressure: 0.0053 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: N[C@@H](C)c1cc(O)ccc1
(2)InChI: InChI=1/C8H11NO/c1-6(9)7-3-2-4-8(10)5-7/h2-6,10H,9H2,1H3/t6-/m0/s1
(3)InChIKey: WFRNDUQAIZJRPZ-LURJTMIEBF
(4)Std. InChI: InChI=1S/C8H11NO/c1-6(9)7-3-2-4-8(10)5-7/h2-6,10H,9H2,1H3/t6-/m0/s1
(5)Std. InChIKey: WFRNDUQAIZJRPZ-LURJTMIESA-N

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