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14334-40-8

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Basic Information
CAS No.: 14334-40-8
Name: Pramiverine
Molecular Structure:
Molecular Structure of 14334-40-8 (Pramiverine)
Formula: C21H27N
Molecular Weight: 293.452
Synonyms: Cyclohexylamine,N-isopropyl-4,4-diphenyl- (8CI);Pramiverina;Pramiverine;Propaminodiphen;4,4-Diphenyl-N-isopropylcyclohexylamine;UNII-157NY06G9T;Pramiverinum;HSP 2986;EMD 9806;
Density: 1.01 g/cm3
Melting Point: 70° (Enenkel)
Boiling Point: 406.9 °C at 760 mmHg
Flash Point: 206 °C
PSA: 12.03000
LogP: 5.30420
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Specification

The Cyclohexanamine,N-(1-methylethyl)-4,4-diphenyl- with CAS registry number of 14334-40-8 is also known as Cyclohexylamine,N-isopropyl-4,4-diphenyl- (8CI). The IUPAC name is 4,4-Diphenyl-N-propan-2-ylcyclohexan-1-amine. In addition, the formula is C21H27N and the molecular weight is 293.45.

Physical properties about Cyclohexanamine,N-(1-methylethyl)-4,4-diphenyl- are: (1)ACD/LogP: 5.35; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 2.25; (4)ACD/LogD (pH 7.4): 2.44; (5)ACD/BCF (pH 5.5): 5.44; (6)ACD/BCF (pH 7.4): 8.37; (7)ACD/KOC (pH 5.5): 15.41; (8)ACD/KOC (pH 7.4): 23.72; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Index of Refraction: 1.571; (13)Molar Refractivity: 94.7 cm3; (14)Molar Volume: 287.9 cm3; (15)Surface Tension: 41.1 dyne/cm; (16)Density: 1.01 g/cm3; (17)Flash Point: 206 °C; (18)Enthalpy of Vaporization: 65.88 kJ/mol; (19)Boiling Point: 406.9 °C at 760 mmHg; (20)Vapour Pressure: 7.83E-07 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
1. Canonical SMILES: CC(C)NC1CCC(CC1)(C2=CC=CC=C2)C3=CC=CC=C3
2. InChI: InChI=1S/C21H27N/c1-17(2)22-20-13-15-21(16-14-20,18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-12,17,20,22H,13-16H2,1-2H3
3. InChIKey: SBEOBYJLAQKTQX-UHFFFAOYSA-N