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Basic Information
CAS No.: 4594-73-4
Name: 6(5H)-Phenanthridinone,5-methyl-(7CI,8CI,9CI)
Molecular Structure:
Molecular Structure of 4594-73-4 (6(5H)-Phenanthridinone,5-methyl-(7CI,8CI,9CI))
Formula: C14H11NO
Molecular Weight: 209.247
Synonyms: 5-Methyl-6(5H)-phenanthridinone;N-Methyl-6-phenanthridone;NSC 141586;
Density: 1.205 g/cm3
Boiling Point: 395.01 °C at 760 mmHg
Flash Point: 191.547 °C
PSA: 22.00000
LogP: 2.69170
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    6(5H)-Phenanthridinone,5-methyl- CAS Number: 4594-73-4 Molecular formula: C14H11NO Molecular weight: 209.24300 Exact quality: 209.08400 PSA: 22.00000 LogP: 2.69170 Physical and chemical properties Density: 1.205g / cm3 Boiling

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Specification

The 6(5H)-Phenanthridinone, 5-methyl-, with the CAS registry number of 4594-73-4, is also known as 5-Methyl-5, 6-dihydrophenanthridine-6-one. It belongs to the product category of Quinolinone. This chemical's molecular formula is C14H11NO and molecular weight is 209.2432. What's more, its IUPAC name is 5-Methylphenanthridin-6-one.

Physical properties about 6(5H)-Phenanthridinone, 5-methyl- are: (1)ACD/LogP: 3.19; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.191; (4)ACD/LogD (pH 7.4): 3.191; (5)ACD/BCF (pH 5.5): 156.826; (6)ACD/BCF (pH 7.4): 156.827; (7)ACD/KOC (pH 5.5): 1297.439; (8)ACD/KOC (pH 7.4): 1297.448; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 20.31 Å2; (13)Index of Refraction: 1.635; (14)Molar Refractivity: 62.201 cm3; (15)Molar Volume: 173.623 cm3; (16)Surface Tension: 47.577 dyne/cm; (17)Density: 1.205 g/cm3; (18)Flash Point: 191.547 °C; (19)Enthalpy of Vaporization: 64.511 kJ/mol; (20)Boiling Point: 395.01 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Cn1c2ccccc2c3ccccc3c1=O
(2) InChI: InChI=1/C14H11NO/c1-15-13-9-5-4-7-11(13)10-6-2-3-8-12(10)14(15)16/h2-9H,1H3
(3) InChIKey: UWZASNFULUENAC-UHFFFAOYAW