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74340-55-9

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Basic Information
CAS No.: 74340-55-9
Name: phenanthridin-8-amine
Molecular Structure:
Molecular Structure of 74340-55-9 (phenanthridin-8-amine)
Formula: C13H10N2
Molecular Weight: 194.2319
Synonyms: Phenanthridine,8-amino- (5CI);8-Aminophenanthridine;
Density: 1.268 g/cm3
Boiling Point: 430.2 °C at 760 mmHg
Flash Point: 243.8 °C
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Specification

The IUPAC name of 8-Phenanthridinamine is phenanthridin-8-amine. With the CAS registry number 74340-55-9, it is also named as Phenanthridine,8-amino- (5CI). In addition, its molecular formula is C13H10N2 and molecular weight is 194.2319.

The other characteristics of 8-Phenanthridinamine can be summarized as: (1)ACD/LogP: 2.03; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 16.13 Å2; (7)Index of Refraction: 1.78; (8)Molar Refractivity: 64.26 cm3; (9)Molar Volume: 153.1 cm3; (10)Polarizability: 25.47×10-24cm3; (11)Surface Tension: 65 dyne/cm; (12)Density: 1.268 g/cm3; (13)Flash Point: 243.8 °C; (14)Enthalpy of Vaporization: 68.56 kJ/mol; (15)Boiling Point: 430.2 °C at 760 mmHg; (16)Vapour Pressure: 1.33E-07 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES: n1cc3c(c2c1cccc2)ccc(c3)N
(2)InChI: InChI=1/C13H10N2/c14-10-5-6-11-9(7-10)8-15-13-4-2-1-3-12(11)13/h1-8H,14H2
(3)InChIKey: AOGCNGQOLXBQSH-UHFFFAOYAS
(4)Std. InChI: InChI=1S/C13H10N2/c14-10-5-6-11-9(7-10)8-15-13-4-2-1-3-12(11)13/h1-8H,14H2
(5)Std. InChIKey: AOGCNGQOLXBQSH-UHFFFAOYSA-N