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59333-79-8

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Basic Information
CAS No.: 59333-79-8
Name: 4-Hydroxydebrisoquine
Article Data: 5
Molecular Structure:
Molecular Structure of 59333-79-8 (4-Hydroxydebrisoquine)
Formula: C10H13 N3 O
Molecular Weight: 191.233
Synonyms: (?à)-4-Hydroxydebrisoquine;4-Hydroxydebrisoquin; Ro 03-7594; Ro 3-7594/001
Density: 1.38g/cm3
Boiling Point: 374.2°C at 760 mmHg
Flash Point: 180.1°C
PSA: 73.34000
LogP: 1.16700
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Chemistry

Molecular Structure of 4-Hydroxydebrisoquine (CAS No.59333-79-8):

Molecular Formula: C10H13N3O 
Molecular Weight: 191.23
CAS No: 59333-79-8
IUPAC Name: 4-Hydroxy-3,4-dihydro-1H-isoquinoline-2-carboximidamide 
H bond acceptors: 4
H bond donors: 4
Freely Rotating Bonds: 1
Polar Surface Area: 28.07 Å2
Index of Refraction: 1.679
Molar Refractivity: 52.16 cm3
Molar Volume: 138.1 cm3
Surface Tension: 60.2 dyne/cm
Density: 1.38 g/cm3
Flash Point: 180.1 °C
Enthalpy of Vaporization: 65.58 kJ/mol
Boiling Point: 374.2 °C at 760 mmHg
Vapour Pressure: 2.89E-06 mmHg at 25°C
InChI: InChI=1/C10H13N3O/c11-10(12)13-5-7-3-1-2-4-8(7)9(14)6-13/h1-4,9,14H,5-6H2,(H3,11,12)
InChIKey: AKFURXZANOMQBD-UHFFFAOYAI
Std. InChI: InChI=1S/C10H13N3O/c11-10(12)13-5-7-3-1-2-4-8(7)9(14)6-13/h1-4,9,14H,5-6H2,(H3,11,12)
Std. InChIKey: AKFURXZANOMQBD-UHFFFAOYSA-N
Product Categories: pharmacetical

Specification

   4-Hydroxydebrisoquine (CAS No.59333-79-8), its synonym is 4-Hydroxy-3,4-dihydro-2(1H)-isoquinolinecarboximidamide .