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74248-90-1

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Basic Information
CAS No.: 74248-90-1
Name: (S)-4-(3-AMINO-BUTYL)-PHENOL
Molecular Structure:
Molecular Structure of 74248-90-1 ((S)-4-(3-AMINO-BUTYL)-PHENOL)
Formula: C10H15NO
Molecular Weight: 165.235
Synonyms: Phenol,4-(3-aminobutyl)-, (S)-;
Density: 1.047 g/cm3
Boiling Point: 295.3 °C at 760 mmHg
Flash Point: 132.4 °C
PSA: 46.25000
LogP: 2.37230
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    (S)-4-(3-AMINO-BUTYL)-PHENOLAppearance:white crystalline powder Storage:Store in dry, dark and ventilated place Package:25KG drum Application:intermediate Transportation:by air, by sea, by express

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Specification

The Phenol,4-[(3S)-3-aminobutyl]-, with the CAS registry number 74248-90-1, is also known as Phenol,4-(3-aminobutyl)-, (S)-. This chemical's molecular formula is C10H15NO and molecular weight is 165.23. Its systematic name is called 4-[(3S)-3-aminobutyl]phenol.

Physical properties of Phenol,4-[(3S)-3-aminobutyl]-: (1)ACD/LogP: 1.44; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 2; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 5; (9)Index of Refraction: 1.552; (10)Molar Refractivity: 50.44 cm3; (11)Molar Volume: 157.7 cm3; (12)Surface Tension: 43.3 dyne/cm; (13)Density: 1.047 g/cm3; (14)Flash Point: 132.4 °C; (15)Enthalpy of Vaporization: 55.64 kJ/mol; (16)Boiling Point: 295.3 °C at 760 mmHg; (17)Vapour Pressure: 0.000874 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Oc1ccc(CC[C@H](C)N)cc1
(2)InChI: InChI=1/C10H15NO/c1-8(11)2-3-9-4-6-10(12)7-5-9/h4-8,12H,2-3,11H2,1H3/t8-/m0/s1
(3)InChIKey: WNTVTQIJPAFZEL-QMMMGPOBBP