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Benzenemethanamine,4-[(hexahydro-4-methyl-1H-1,4-diazepin-1-yl)methyl]-N-methyl-

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Name

Benzenemethanamine,4-[(hexahydro-4-methyl-1H-1,4-diazepin-1-yl)methyl]-N-methyl-

EINECS N/A
CAS No. 884507-55-5 Density 1.004 g/cm3
PSA 18.51000 LogP 1.81020
Solubility N/A Melting Point N/A
Formula C15H25N3 Boiling Point 342.9 °C at 760 mmHg
Molecular Weight 247.3791 Flash Point 159.7 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 884507-55-5 (N-Methyl-4-[(4-methylhomopiperazin-1-yl)methyl]benzylamine) Hazard Symbols CorrosiveC
Synonyms

N-Methyl-4-[(4-methylhomopiperazin-1-yl)methyl]benzylamine;N-METHYL-4-[(4-METHYLPERHYDRO-1,4-DIAZEPIN-1-YL)METHYL]BENZYLAMINE

 

Benzenemethanamine,4-[(hexahydro-4-methyl-1H-1,4-diazepin-1-yl)methyl]-N-methyl- Specification

The Benzenemethanamine,4-[(hexahydro-4-methyl-1H-1,4-diazepin-1-yl)methyl]-N-methyl- is an organic compound with the formula C15H25N3. The systematic name of this chemical is N-methyl-1-[4-[(4-methyl-1,4-diazepan-1-yl)methyl]phenyl]methanamine. With the CAS registry number 884507-55-5, it is also named as N-Methyl-4-[(4-methylhomopiperazin-1-yl)methyl]benzylamine.

Physical properties about Benzenemethanamine,4-[(hexahydro-4-methyl-1H-1,4-diazepin-1-yl)methyl]-N-methyl- are: (1)D/LogP: 0.97; (2)#H bond acceptors: 3; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 4; (5)Polar Surface Area: 18.51 Å2; (6)Index of Refraction: 1.539; (7)Molar Refractivity: 77.21 cm3; (8)Molar Volume: 246.2 cm3; (9)Polarizability: 30.6×10-24cm3; (10)Surface Tension: 38.6 dyne/cm; (11)Density: 1.004 g/cm3; (12)Flash Point: 159.7 °C; (13)Enthalpy of Vaporization: 58.67 kJ/mol; (14)Boiling Point: 342.9 °C at 760 mmHg; (15)Vapour Pressure: 7.28E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CNCc1ccc(cc1)CN2CCCN(CC2)C
(2)InChI: InChI=1/C15H25N3/c1-16-12-14-4-6-15(7-5-14)13-18-9-3-8-17(2)10-11-18/h4-7,16H,3,8-13H2,1-2H3
(3)InChIKey: IAMOTCGZNDFBJW-UHFFFAOYAK
(4)Std. InChI: InChI=1S/C15H25N3/c1-16-12-14-4-6-15(7-5-14)13-18-9-3-8-17(2)10-11-18/h4-7,16H,3,8-13H2,1-2H3
(5)Std. InChIKey: IAMOTCGZNDFBJW-UHFFFAOYSA-N

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