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76600-67-4

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Basic Information
CAS No.: 76600-67-4
Name: Tecoflex
Molecular Structure:
Molecular Structure of 76600-67-4 (Tecoflex)
Formula: C43H76N4O8
Molecular Weight: 777.08554
Synonyms: Tecoflex;
Density: 1.11 g/cm3
Boiling Point: 861.1 °C at 760 mmHg
Flash Point: 474.6 °C
PSA: 167.28000
LogP: 10.49470
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    Hubei Jiutian Bio-medical Technology CO.,Ltd, which is professional in research and sale high techology.The company located in Wuhan, We insist on the concept of "technology first,

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Specification

The Tecoflex, with the CAS registry number 76600-67-4, has the IUPAC name 4-[[4-[[4-(pentoxycarbonylamino)cyclohexyl]methyl]cyclohexyl]carbamoyloxy]butyl N-[4-[[4-(butoxycarbonylamino)cyclohexyl]methyl]cyclohexyl]carbamate. Its molecular formula is C43H76N4O8 and its molecular weight is 777.08554.

Other characteristics of the Tecoflex can be summarised as followings: (1)ACD/LogP: 11.51; (2)# of Rule of 5 Violations: 3; (3)ACD/LogD (pH 5.5): 11.51; (4)ACD/LogD (pH 7.4): 11.51; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 10000000; (8)ACD/KOC (pH 7.4): 10000000; (9)#H bond acceptors: 12; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 24; (12)Polar Surface Area: 118.16 Å2; (13)Index of Refraction: 1.527; (14)Molar Refractivity: 214.85 cm3; (15)Molar Volume: 697.9 cm3; (16)Polarizability: 85.17×10-24cm3; (17)Surface Tension: 47.6 dyne/cm; (18)Density: 1.11 g/cm3; (19)Flash Point: 474.6 °C; (20)Enthalpy of Vaporization: 125.13 kJ/mol; (21)Boiling Point: 861.1 °C at 760 mmHg; (22)Vapour Pressure: 5.05E-30 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: O=C(OCCCCOC(=O)NC2CCC(CC1CCC(NC(=O)OCCCC)CC1)CC2)NC3CCC(CC3)CC4CCC(NC(=O)OCCCCC)CC4
2.InChI: InChI=1/C43H76N4O8/c1-3-5-7-27-53-41(49)45-37-20-12-33(13-21-37)31-35-16-24-39(25-17-35)47-43(51)55-29-9-8-28-54-42(50)46-38-22-14-34(15-23-38)30-32-10-18-36(19-11-32)44-40(48)52-26-6-4-2/h32-39H,3-31H2,1-2H3,(H,44,48)(H,45,49)(H,46,50)(H,47,51)
3.InChIKey: DSUFPYCILZXJFF-UHFFFAOYAS