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176045-80-0

Basic Information
CAS No.: 176045-80-0
Name: 1-(4-Bromobenzyl)-1-(4-methoxyphenyl)hydrazine
Article Data: 2
Molecular Structure:
Molecular Structure of 176045-80-0 (1-(4-Bromobenzyl)-1-(4-methoxyphenyl)hydrazine)
Formula: C14H15BrN2O
Molecular Weight: 307.19
Synonyms: N-(4-Bromobenzyl)-N-(4-methoxyphenyl)hydrazine;
Density: 1.425 g/cm3
Boiling Point: 445 °C at 760 mmHg
Flash Point: 222.9 °C
PSA: 38.49000
LogP: 4.03830
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Specification

The 1-(4-Bromobenzyl)-1-(4-methoxyphenyl)hydrazine with the cas number 176045-80-0 is also called Hydrazine,1-[(4-bromophenyl)methyl]-1-(4-methoxyphenyl)-. Its molecular formula is C14H15BrN2O. This chemical should be stored in dry and cool environment.

The properties of the chemical are: (1)ACD/LogP: 2.50; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.39; (4)ACD/LogD (pH 7.4): 2.49; (5)ACD/BCF (pH 5.5): 36.44; (6)ACD/BCF (pH 7.4): 46.32; (7)ACD/KOC (pH 5.5): 425.9; (8)ACD/KOC (pH 7.4): 541.42; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 38.49 Å2; (13)Index of Refraction: 1.647; (14)Molar Refractivity: 78.32 cm3; (15)Molar Volume: 215.4 cm3; (16)Polarizability: 31.05×10-24cm3; (17)Surface Tension: 51.7 dyne/cm; (18)Enthalpy of Vaporization: 70.29 kJ/mol; (19)Vapour Pressure: 4.09×10-8 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc2ccc(CN(N)c1ccc(OC)cc1)cc2
(2)InChI: InChI=1/C14H15BrN2O/c1-18-14-8-6-13(7-9-14)17(16)10-11-2-4-12(15)5-3-11/h2-9H,10,16H2,1H3
(3)InChIKey: VNMAXLTXXYCFHZ-UHFFFAOYAT