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951625-97-1

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Basic Information
CAS No.: 951625-97-1
Name: 4-Tert-butoxycyclohexanamine
Molecular Structure:
Molecular Structure of 951625-97-1 (4-Tert-butoxycyclohexanamine)
Formula: C10H21NO
Molecular Weight: 171.283
Synonyms: 4-TERT-BUTOXYCYCLOHEXANAMINE;CyclohexanaMine, 4-(1,1-diMethylethoxy)-;4-(1,1-Dimethylethoxy)cyclohexanamine
EINECS: 604-604-1
Density: 0.91g/cm3
Boiling Point: 225.3 °C at 760 mmHg
Flash Point: 75.1 °C
PSA: 35.25000
LogP: 2.77170
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Specification

The 4-Tert-butoxycyclohexanamine, with CAS registry number 951625-97-1, has the systematic name of 4-tert-butoxycyclohexan-1-amine. Besides this, it is also called cyclohexanamine, 4-(1,1-dimethylethoxy)-. And the chemical formula of this chemical is C10H21NO.

Physical properties of 4-Tert-butoxycyclohexanamine: (1)ACD/LogP: 1.56; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 35.25 Å2; (7)Index of Refraction: 1.464; (8)Molar Refractivity: 51.62 cm3; (9)Molar Volume: 186.9 cm3; (10)Polarizability: 20.46×10-24cm3; (11)Surface Tension: 31.5 dyne/cm; (12)Density: 0.91 g/cm3; (13)Flash Point: 75.1 °C; (14)Enthalpy of Vaporization: 46.18 kJ/mol; (15)Boiling Point: 225.3 °C at 760 mmHg; (16)Vapour Pressure: 0.0871 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)(C)OC1CCC(N)CC1
(2)InChI: InChI=1/C10H21NO/c1-10(2,3)12-9-6-4-8(11)5-7-9/h8-9H,4-7,11H2,1-3H3
(3)InChIKey: IJCTXLVZPMAIJS-UHFFFAOYAH
(4)Std. InChI: InChI=1S/C10H21NO/c1-10(2,3)12-9-6-4-8(11)5-7-9/h8-9H,4-7,11H2,1-3H3
(5)Std. InChIKey: IJCTXLVZPMAIJS-UHFFFAOYSA-N