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endo-3-Aminotropane

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Name

endo-3-Aminotropane

EINECS 1533716-785-6
CAS No. 87571-88-8 Density 0.99 g/cm3
PSA 29.26000 LogP 1.20850
Solubility N/A Melting Point N/A
Formula C8H16N2 Boiling Point 181.6 °C at 760 mmHg
Molecular Weight 140.228 Flash Point 60.8 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 87571-88-8 (endo-3-Aminotropane) Hazard Symbols N/A
Synonyms

(3-endo)-8-Methyl-8-azabicyclo[3.2.1]octan-3-amine;

 

endo-3-Aminotropane Specification

The endo-3-Aminotropane, with the CAS registry number of 87571-88-8, is also known as (3-endo)-8-Methyl-8-azabicyclo[3.2.1]octan-3-amine. This chemical's molecular formula is C8H16N2 and molecular weight is 140.22. What's more, its systematic name is called (1R,5S)-8-Methyl-8-azabicyclo[3.2.1]octan-3-amine.

Physical properties about the endo-3-Aminotropane are: (1)ACD/LogP: 0.35; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 29.26 Å2; (7)Index of Refraction: 1.507; (8)Molar Refractivity: 42.16 cm3; (9)Molar Volume: 141.5 cm3; (10)Surface Tension: 33.7 dyne/cm; (11)Density: 0.99 g/cm3; (12)Flash Point: 60.8 °C; (13)Enthalpy of Vaporization: 41.79 kJ/mol; (14)Boiling Point: 181.6 °C at 760 mmHg; (15)Vapour Pressure: 0.843 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES:CN1C2CCC1CC(C2)N
(2) InChI:InChI=1/C8H16N2/c1-10-7-2-3-8(10)5-6(9)4-7/h6-8H,2-5,9H2,1H3/t6-,7+,8-
(3) InChIKey:HJGMRAKQWLKWMH-RNLVFQAGBC

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