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13286-59-4

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Basic Information
CAS No.: 13286-59-4
Name: (1S,2S)-1-AMINO-2,3-DIHYDRO-1H-INDEN-2-OL
Article Data: 68
Molecular Structure:
Molecular Structure of 13286-59-4 ((1S,2S)-1-AMINO-2,3-DIHYDRO-1H-INDEN-2-OL)
Formula: C9H11NO
Molecular Weight: 149.192
Synonyms: 1H-Inden-2-ol,1-amino-2,3-dihydro-, trans-;2-Indanol, 1-amino-, trans- (8CI);(?à)-trans-1-Amino-2-indanol;trans-1-Amino-2-hydroxyindan;
Density: 1.212g/cm3
Boiling Point: 290 °C at 760 mmHg
Flash Point: 129.2 °C
PSA: 46.25000
LogP: 1.30370
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Specification

The (1S,2S)-1-Amino-2-indanol, with cas registry number 13286-59-4, has the systematic name of (1S,2S)-1-amino-2,3-dihydro-1H-inden-2-ol. Besides this, it is also called 1H-Inden-2-ol, 1-amino-2,3-dihydro-, (1S,2S)-.

Physical properties about this chemical are: (1)ACD/LogP: 0.43; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 12.47 Å2; (7)Index of Refraction: 1.626; (8)Molar Refractivity: 43.57 cm3; (9)Molar Volume: 123 cm3; (10)Polarizability: 17.27×10-24cm3; (11)Surface Tension: 51.7 dyne/cm; (12)Enthalpy of Vaporization: 55.91 kJ/mol; (13)Vapour Pressure: 0.000978 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
(1)SMILES: O[C@H]2Cc1ccccc1[C@@H]2N
(2)InChI: InChI=1/C9H11NO/c10-9-7-4-2-1-3-6(7)5-8(9)11/h1-4,8-9,11H,5,10H2/t8-,9-/m0/s1
(3)InChIKey: LOPKSXMQWBYUOI-IUCAKERBBK
(4)Std. InChI: InChI=1S/C9H11NO/c10-9-7-4-2-1-3-6(7)5-8(9)11/h1-4,8-9,11H,5,10H2/t8-,9-/m0/s1
(5)Std. InChIKey: LOPKSXMQWBYUOI-IUCAKERBSA-N