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37571-28-1

Basic Information
CAS No.: 37571-28-1
Name: 1,4,7-Triazabicyclo[5.2.2]undecane(9CI)
Molecular Structure:
Molecular Structure of 37571-28-1 (1,4,7-Triazabicyclo[5.2.2]undecane(9CI))
Formula: C8H17N3
Molecular Weight: 155.2407
Synonyms: 1,4,7-Triazabicyclo[5.2.2]undecane(9CI);1,4,7-TRIAZABICYCLO[5.2.2]UNDECAN
Density: 1.074 g/cm3
Boiling Point: 247.978 °C at 760 mmHg
Flash Point: 118.469 °C
PSA: 18.51000
LogP: -0.58820
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    1,4,7-Triazabicyclo[5.2.2]undecane

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    1,4,7-Triazabicyclo[5.2.2]undecane

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    hight degree of purity Application:Fine chemical intermediates, used as the main raw material for he synthesis of various pesticides, medicines, surfactants, polymer monomers, Ond Ontifungal agents

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    1,4,7-TRIAZABICYCLO[5.2.2]UNDECANCAS

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    1,4,7-TRIAZABICYCLO[5.2.2]UNDECANCASAppearance:white crystalline powder Storage:Store in dry, dark and ventilated place Package:25KG drum Application:intermediate Transportation:by air, by sea, by express

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    1,4,7-Triazabicyclo[5.2.2]undecane

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    1,4,7-Triazabicyclo[5.2.2]undecane

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Specification

The CAS registry number of 1,4,7-Triazabicyclo[5.2.2]undecane is 37571-28-1. It belongs to the product category of Piperidine. This chemical's molecular formula is C8H17N3 and molecular weight is 155.2407. 

Physical properties about 1,4,7-Triazabicyclo[5.2.2]undecane are: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 3; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 0; (9)Polar Surface Area: 18.51 Å2; (10)Index of Refraction: 1.556; (11)Molar Refractivity: 46.414 cm3; (12)Molar Volume: 144.493 cm3; (13)Polarizability: 18.4×10-24 cm3; (14)Surface Tension: 44.06 dyne/cm; (15)Density: 1.074 g/cm3; (16)Flash Point: 118.469 °C; (17)Enthalpy of Vaporization: 48.516 kJ/mol; (18)Boiling Point: 247.978 °C at 760 mmHg; (19)Vapour Pressure: 0.025 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: C1CN2CCN(CCN1)CC2
(2) InChI: InChI=1/C8H17N3/c1-3-10-5-7-11(8-6-10)4-2-9-1/h9H,1-8H2
(3) InChIKey: IYNGLSRZLOHZJA-UHFFFAOYAH