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2305-85-3

Basic Information
CAS No.: 2305-85-3
Name: 2-Quinazolinamine, 5,6,7,8-tetrahydro- (9CI)
Article Data: 10
Molecular Structure:
Molecular Structure of 2305-85-3 (2-Quinazolinamine, 5,6,7,8-tetrahydro- (9CI))
Formula: C8H11N3
Molecular Weight: 149.195
Synonyms: Quinazoline,2-amino-5,6,7,8-tetrahydro- (6CI,7CI,8CI);NSC 13568;
Density: 1.193 g/cm3
Melting Point: 208-210 °C
Boiling Point: 361.5 °C at 760 mmHg
Flash Point: 199.9 °C
PSA: 51.80000
LogP: 1.51880
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Specification

The 2-Quinazolinamine,5,6,7,8-tetrahydro- is an organic compound with the formula C8H11N3. The IUPAC name of this chemical is 5,6,7,8-Tetrahydroquinazolin-2-amine. With the CAS registry number 2305-85-3, it is also named as 5,6,7,8-Tetrahydroquinazoline-2-ylamine. The category of the product is Benzenes. Besides, its molecular weight is 149.193.

The physical properties of 2-Quinazolinamine,5,6,7,8-tetrahydro- are: (1)ACD/LogP: 1.47; (2)#H bond acceptors: 3; (3)#H bond donors: 2; (4)Polar Surface Area: 29.02 Å2; (5)Index of Refraction: 1.612; (6)Molar Refractivity: 43.45 cm3; (7)Molar Volume: 124.9 cm3; (8)Polarizability: 17.22×10-24 cm3; (9)Surface Tension: 59.8 dyne/cm; (10)Density: 1.193 g/cm3; (11)Flash Point: 199.9 °C; (12)Enthalpy of Vaporization: 60.74 kJ/mol; (13)Boiling Point: 361.5 °C at 760 mmHg; (14)Vapour Pressure: 2.06E-05 mmHg at 25 °C.

Preparation: this chemical can be prepared by 2-Dimethylaminomethylen-cyclohexanon and guanidine; hydrochloride. This reaction will need reagent EtONa and solvent ethanol. The yield is about 75%.

2-Quinazolinamine,5,6,7,8-tetrahydro- can be obtained by 2-Dimethylaminomethylen-cyclohexanon and guanidine; hydrochloride

You can still convert the following datas into molecular structure:
(1)SMILES: n1c2c(cnc1N)CCCC2
(2)InChI: InChI=1/C8H11N3/c9-8-10-5-6-3-1-2-4-7(6)11-8/h5H,1-4H2,(H2,9,10,11)
(3)InChIKey: AIOOBFYEASSZHV-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C8H11N3/c9-8-10-5-6-3-1-2-4-7(6)11-8/h5H,1-4H2,(H2,9,10,11)
(5)Std. InChIKey: AIOOBFYEASSZHV-UHFFFAOYSA-N