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253324-92-4

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Basic Information
CAS No.: 253324-92-4
Name: 2H-3-BENZAZEPIN-2-ONE,1-AMINO-1,3,4,5-TETRAHYDRO-3-METHYL-,(1S)-
Article Data: 2
Molecular Structure:
Molecular Structure of 253324-92-4 (2H-3-BENZAZEPIN-2-ONE,1-AMINO-1,3,4,5-TETRAHYDRO-3-METHYL-,(1S)-)
Formula: C11H14 N2 O
Molecular Weight: 190.245
Synonyms: 2H-3-BENZAZEPIN-2-ONE,1-AMINO-1,3,4,5-TETRAHYDRO-3-METHYL-,(1S)-;(1S)-1-Amino-1,3,4,5-tetrahydro-3-methyl-2H-3-benzazepin-2-one
Density: 1.124
Melting Point: 98-99 ºC
Boiling Point: 372.7°C at 760 mmHg
Flash Point: 179.2°C
PSA: 46.33000
LogP: 1.33910
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Chemistry

Molecular Structure of (1S)-1-Amino-1,3,4,5-tetrahydro-3-methyl-2H-3-benzazepin-2-one (CAS No.253324-92-4):
 
Molecular Formula: C11H14N2O 
Molecular Weight: 190.24
CAS No: 253324-92-4
H bond acceptors: 3
H bond donors: 2
Freely Rotating Bonds: 1
Polar Surface Area: 46.33 Å2
Index of Refraction: 1.563
Molar Refractivity: 54.99 cm3
Molar Volume: 169.1 cm3
Surface Tension: 42.5 dyne/cm
Density: 1.124 g/cm3
Flash Point: 179.2 °C
Enthalpy of Vaporization: 61.99 kJ/mol
Boiling Point: 372.7 °C at 760 mmHg
Vapour Pressure: 9.42E-06 mmHg at 25°C
InChI: InChI=1/C11H14N2O/c1-13-7-6-8-4-2-3-5-9(8)10(12)11(13)14/h2-5,10H,6-7,12H2,1H3/t10-/m0/s1
InChIKey: RETLCOJLSHBJEZ-JTQLQIEIBK
Std. InChI: InChI=1S/C11H14N2O/c1-13-7-6-8-4-2-3-5-9(8)10(12)11(13)14/h2-5,10H,6-7,12H2,1H3/t10-/m0/s1
Std. InChIKey: RETLCOJLSHBJEZ-JTQLQIEISA-N

Specification

   (1S)-1-Amino-1,3,4,5-tetrahydro-3-methyl-2H-3-benzazepin-2-one (CAS No.253324-92-4), its synonyms are (1S)-1-Amino-3-methyl-1,3,4,5-tetrahydro-2H-3-benzazepin-2-on ; (1S)-1-Amino-3-methyl-1,3,4,5-tetrahydro-2H-3-benzazepin-2-one ; 2H-3-benzazepin-2-one, 1-amino-1,3,4,5-tetrahydro-3-methyl-,(1S)- ; (1S)-1-Amino-1,3,4,5-tetrahydro-3-methyl-2H-3-benzazepin-2-one