7-Fluoroquinazolin-4-amine supplier

Name
7-Fluoroquinazolin-4-amine
EINECS
CAS No. 1009036-29-6
Article Data2
CAS DataBase
Density 1.401 g/cm³
Solubility
Melting Point
Formula C₈H₆FN₃
Boiling Point 331.81 °C at 760 mmHg
Molecular Weight 163.1517
Flash Point 154.473 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Amino-7-fluoroquinazoline
PSA 51.80000
LogP 1.93230

7-Fluoroquinazolin-4-amine Specification

The 7-Fluoroquinazolin-4-amine, with the CAS registry number 1009036-29-6, is also known as 4-Quinazolinamine, 7-fluoro-. This chemical's molecular formula is C₈H₆FN₃ and molecular weight is 163.1517. What's more, both its IUPAC name and systematic name are the same which is called 7-Fluoroquinazolin-4-amine.

Physical properties about 7-Fluoroquinazolin-4-amine are: (1)ACD/LogP: 1.43; (2)#of Rule of 5 Violations: 0; (3) ACD/LogD (pH 7.4): 1.287; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 5.166; (6)ACD/KOC (pH 5.5): 4.835; (7)ACD/KOC (pH 7.4): 102.56; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 0; (11)Polar Surface Area: 51.8 Å²; (12)Index of Refraction: 1.69; (13)Molar Refractivity: 44.508 cm³; (14)Molar Volume: 116.487 cm³; (15)Polarizability: 17.6447×10^-24cm³; (16)Surface Tension: 66.272 dyne/cm; (17)Density: 1.401 g/cm³; (18)Flash Point: 154.473 °C; (19)Enthalpy of Vaporization: 57.452 kJ/mol; (20)Boiling Point: 331.81 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: c1cc2c(cc1F)ncnc2N
(2) InChI: InChI=1/C8H6FN3/c9-5-1-2-6-7(3-5)11-4-12-8(6)10/h1-4H,(H2,10,11,12)
(3) InChIKey: OYFIRSZBPDFONT-UHFFFAOYAO

Product Name

7-Fluoroquinazolin-4-amine

7-Fluoroquinazolin-4-amine Specification

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