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153139-56-1

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Basic Information
CAS No.: 153139-56-1
Name: 3-[(Dimethylamino)methyl]-9-methyl-1,2,3,9-tetrahydro-4H-carbazol-4-one
Molecular Structure:
Molecular Structure of 153139-56-1 (3-[(Dimethylamino)methyl]-9-methyl-1,2,3,9-tetrahydro-4H-carbazol-4-one)
Formula: C16H20N2O
Molecular Weight: 256.348
Synonyms: 3-dimethylaminomethyl-9-methyl-1,2,3,4-tetrahydro-4-oxocarbazole;
Density: 1.16 g/cm3
Boiling Point: 416.7 °C at 760 mmHg
Flash Point: 205.8 °C
PSA: 25.24000
LogP: 2.48500
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Specification

This chemical is called 3-[(Dimethylamino)methyl]-9-methyl-1,2,3,9-tetrahydro-4H-carbazol-4-one, and its systematic name is 4H-carbazol-4-one, 3-[(dimethylamino)methyl]-1,2,3,9-tetrahydro-9-methyl-. With the molecular formula of C16H20N2O, its molecular weight is 256.34. The CAS registry number of this chemical is 153139-56-1.

Other characteristics of the 3-[(Dimethylamino)methyl]-9-methyl-1,2,3,9-tetrahydro-4H-carbazol-4-one can be summarised as followings: (1)ACD/LogP: 2.27; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 25.24 Å2; (7)Index of Refraction: 1.612; (8)Molar Refractivity: 76.84 cm3; (9)Molar Volume: 220.9 cm3; (10)Polarizability: 30.46×10-24cm3; (11)Surface Tension: 41 dyne/cm; (12)Density: 1.16 g/cm3; (13)Flash Point: 205.8 °C; (14)Enthalpy of Vaporization: 67 kJ/mol; (15)Boiling Point: 416.7 °C at 760 mmHg; (16)Vapour Pressure: 3.75E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: O=C3c2c1c(cccc1)n(c2CCC3CN(C)C)C
2.InChI: InChI=1/C16H20N2O/c1-17(2)10-11-8-9-14-15(16(11)19)12-6-4-5-7-13(12)18(14)3/h4-7,11H,8-10H2,1-3H3
3.InChIKey: BSGMMRNLRWFVHL-UHFFFAOYAM