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209984-30-5

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Basic Information
CAS No.: 209984-30-5
Name: 6H-DIBENZ[B,D]AZEPIN-6-ONE, 5,7-DIHYDRO-5-METHYL-
Article Data: 10
Molecular Structure:
Molecular Structure of 209984-30-5 (6H-DIBENZ[B,D]AZEPIN-6-ONE, 5,7-DIHYDRO-5-METHYL-)
Formula: C15H13NO
Molecular Weight: 223.274
Synonyms: 5-Methyl-5,7-dihydro-6H-dibenzo[b,d]azepin-6-on;6H-dibenz[b,d]azepin-6-one, 5,7-dihydro-5-methyl-;
Density: 1.166 g/cm3
Melting Point: 155-160℃
Boiling Point: 474.1 °C at 760 mmHg
Flash Point: 238.5 °C
PSA: 20.31000
LogP: 2.93750
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Specification

This chemical is called 5,7-Dihydro-5-methyl-6H-dibenz[b,d]azepin-6-one, and it can also be named as 6H-dibenz[b,d]azepin-6-one, 5,7-dihydro-5-methyl-, With the molecular formula of C15H13NO, its molecular weight is 223.27. The CAS registry number of this chemical is 209984-30-5. 

Other characteristics of the 5,7-Dihydro-5-methyl-6H-dibenz[b,d]azepin-6-one can be summarised as followings: (1)ACD/LogP: 3.35; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.35; (4)ACD/LogD (pH 7.4): 3.35; (5)#H bond acceptors: 2; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 0; (8)Polar Surface Area: 20.31 Å2; (9)Index of Refraction: 1.615; (10)Molar Refractivity: 66.81 cm3; (11)Molar Volume: 191.3 cm3; (12)Polarizability: 26.48×10-24cm3; (13)Surface Tension: 45.1 dyne/cm; (14)Density: 1.166 g/cm3; (15)Flash Point: 238.5 °C; (16)Enthalpy of Vaporization: 73.74 kJ/mol; (17)Boiling Point: 474.1 °C at 760 mmHg; (18)Vapour Pressure: 3.7E-09 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: CN1c2ccccc2-c3ccccc3CC1=O
2.InChI: InChI=1/C15H13NO/c1-16-14-9-5-4-8-13(14)12-7-3-2-6-11(12)10-15(16)17/h2-9H,10H2,1H3
3.InChIKey: VLYOZVMUFWIJIQ-UHFFFAOYAX