(R)-(-)-3-Chloromandelic acid
1. Introduction of(R)-(-)-3-Chloromandelic acid
The (R)-(-)-3-Chloromandelic acid, with its CAS NO61008-98-8, is a kind ofwithe powder. It
1. Introduction of (R)-(-)-3-Chloromandelic acid
The (R)-(-)-3-Chloromandelic acid, with its CAS NO 61008-98-8, is a kind of withe powder. It has synonyms of Benzeneaceticacid, 3-chloro-a-hydroxy-,(R)-;(R)-(3-Chlorophenyl)hydroxyacetic acid;(R)-2-(3-Chlorophenyl)-2-hydroxyethanoic acid;(R)-3-Chloromandelic acid (R)-m-Chloromandelic acid.
2. Properties of (R)-(-)-3-Chloromandelic acid
(1) ACD/LogP: 1.285 (2) ACD/LogD (pH 5.5): -1.40 (3) ACD/LogD (pH 7.4): -2.41
(4) ACD/BCF (pH 5.5): 1.00 (5) ACD/BCF (pH 7.4): 1.00
(6) ACD/KOC (pH 5.5): 1.00 (7) ACD/KOC (pH 7.4): 1.00
(8) #H bond acceptors: 3 (9) #H bond donors: 2
(10) #Freely Rotating Bonds: 3 (11) Polar Surface Area: 57.53 2
(12) Index of Refraction: 1.606 (13) Molar Refractivity: 43.799 cm3
(14) Molar Volume: 127.081 cm3 (15) Polarizability: 17.363 10-24cm3
(16) Surface Tension: 62.2280006408691 dyne/cm (17) Density: 1.468 g/cm3
(18) Flash Point: 164.393 °C (19) Enthalpy of Vaporization: 62.535 kJ/mol
(20) Boiling Point: 348.211 °C at 760 mmHg
3. Structure descriptors of (R)-(-)-3-Chloromandelic acid
SMILES:Clc1cc(ccc1)[C@@H](O)C(=O)O
Std. InChI:InChI=1S/C8H7ClO3/c9-6-3-1-2-5(4-6)7(10)8(11)12/h1-4,7,10H,(H,11,12)/t7-/m1/s1
Std. InChIKey:SAMVPMGKGGLIPF-SSDOTTSWSA-N
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