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(2S,3R)-3-Amino-2-hydroxyheptanoic acid

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Name

(2S,3R)-3-Amino-2-hydroxyheptanoic acid

EINECS N/A
CAS No. 334871-10-2 Density 1.033 g/cm3
PSA 83.55000 LogP 0.64970
Solubility N/A Melting Point N/A
Formula C7H15NO3 Boiling Point 289.1 °C at 760 mmHg
Molecular Weight 161.201 Flash Point 128.6 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 334871-10-2 ((2S,3R)-3-Amino-2-hydroxyheptanoic acid) Hazard Symbols N/A
Synonyms

(2S,3R)-3-Amino-2-hydroxyheptanoic acid;

Article Data 3

(2S,3R)-3-Amino-2-hydroxyheptanoic acid Specification

The CAS register number of (2S,3R)-3-Amino-2-hydroxyheptanoic acid is 334871-10-2. It also can be called as Heptanoic acid,3-amino-2-hydroxy-, (2S,3R)- and the systematic name about this chemical is (4R)-4-tert-butyl-1,3-oxazolidin-2-one.

Physical properties about (2S,3R)-3-Amino-2-hydroxyheptanoic acid are: (1)ACD/LogP: 1.39; (2)ACD/LogD (pH 5.5): 1.39; (3)ACD/LogD (pH 7.4): 1.39; (4)ACD/BCF (pH 5.5): 6.73; (5)ACD/BCF (pH 7.4): 6.73; (6)ACD/KOC (pH 5.5): 136.28; (7)ACD/KOC (pH 7.4): 136.28; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 29.54Å2; (12)Index of Refraction: 1.448; (13)Molar Refractivity: 37.11 cm3; (14)Molar Volume: 138.5 cm3; (15)Polarizability: 14.71x10-24cm3; (16)Surface Tension: 31.7 dyne/cm; (17)Enthalpy of Vaporization: 52.84 kJ/mol; (18)Boiling Point: 289.1 °C at 760 mmHg; (19)Vapour Pressure: 0.00225 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C1OC[C@H](N1)C(C)(C)C
(2)InChI: InChI=1/C7H13NO2/c1-7(2,3)5-4-10-6(9)8-5/h5H,4H2,1-3H3,(H,8,9)/t5-/m0/s1
(3)InChIKey: WKUHGFGTMLOSKM-YFKPBYRVBT
(4)Std. InChI: InChI=1S/C7H13NO2/c1-7(2,3)5-4-10-6(9)8-5/h5H,4H2,1-3H3,(H,8,9)/t5-/m0/s1
(5)Std. InChIKey: WKUHGFGTMLOSKM-YFKPBYRVSA-N

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