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404337-71-9

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Basic Information
CAS No.: 404337-71-9
Name: (R)-Chroman-2-ylmethanaine
Article Data: 7
Molecular Structure:
Molecular Structure of 404337-71-9 ((R)-Chroman-2-ylmethanaine)
Formula: C10H13NO
Molecular Weight: 163.219
Synonyms: (R)-Chroman-2-ylmethanaine
Density: 1.073 g/cm3
Boiling Point: 278.951 °C at 760 mmHg
Flash Point: 129.241 °C
PSA: 35.25000
LogP: 2.03920
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Specification

The (R)-Chroman-2-ylmethanaine, with the CAS registry number 404337-71-9, has molecular formula C10H13NO. In addition, this chemical's molecular weight is 163.2163. Its systematic name is called 1-[(2R)-3,4-dihydro-2H-chromen-2-yl]methanamine.

Physical properties of (R)-Chroman-2-ylmethanaine: (1)ACD/LogP: 1.91; (2)ACD/LogD (pH 5.5): -1; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 4; (7)#H bond acceptors: 2; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 2; (10)Index of Refraction: 1.548; (11)Molar Refractivity: 48.261 cm3; (12)Molar Volume: 152.048 cm3; (13)Surface Tension: 43.939 dyne/cm; (14)Density: 1.073 g/cm3; (15)Flash Point: 129.241 °C; (16)Enthalpy of Vaporization: 51.76 kJ/mol; (17)Boiling Point: 278.951 °C at 760 mmHg; (18)Vapour Pressure: 0.004 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O2c1ccccc1CC[C@@H]2CN
(2)InChI: InChI=1/C10H13NO/c11-7-9-6-5-8-3-1-2-4-10(8)12-9/h1-4,9H,5-7,11H2/t9-/m1/s1
(3)InChIKey: BSRHATGBRQMDRF-SECBINFHBZ