5-Fluoropyrimidin-4-amine supplier

Name
5-fluoropyrimidin-4-amine
EINECS
CAS No. 811450-26-7
Article Data3
CAS DataBase
Density 1.372 g/cm³
Solubility
Melting Point
Formula C₄H₄FN₃
Boiling Point 222.7 °C at 760 mmHg
Molecular Weight 113.09
Flash Point 88.5 °C
Transport Information
Appearance
Safety 24/25
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Amino-5-fluoro-2(1H)-pyrimidine;
PSA 51.80000
LogP 0.77910

5-Fluoropyrimidin-4-amine Specification

The 4-Pyrimidinamine,5-fluoro-, with the CAS registry number 811450-26-7, is also known as 4-Amino-5-fluoro-2(1H)-pyrimidine. This chemical's molecular formula is C₄H₄FN₃ and molecular weight is 113.09. What's more, its systematic name is called 5-Fluoropyrimidin-4-amine.

Physical properties about 4-Pyrimidinamine,5-fluoro- are: (1) ACD/LogP: 0.34; (2) # of Rule of 5 Violations: 0; (3) ACD/LogD (pH 5.5): 0.28; (4) ACD/LogD (pH 7.4): 0.34; (5) ACD/BCF (pH 5.5): 1; (6) ACD/BCF (pH 7.4): 1.06; (7) ACD/KOC (pH 5.5): 31.57; (8) ACD/KOC (pH 7.4): 36.33; (9)#H bond acceptors: 3; (10) #H bond donors: 2; (11) #Freely Rotating Bonds: 0; (12) Polar Surface Area: 29.02 Å²; (13) Index of Refraction: 1.56; (14) Molar Refractivity: 26.66 cm³; (15) Molar Volume: 82.3 cm³; (16) Surface Tension: 59.2 dyne/cm; (17) Density: 1.372 g/cm³; (18) Flash Point: 88.5 °C; (19) Enthalpy of Vaporization: 45.92 kJ/mol; (20) Boiling Point: 222.7 °C at 760 mmHg; (21) Vapour Pressure: 0.1 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Fc1c(ncnc1)N
(2) InChI: InChI=1/C4H4FN3/c5-3-1-7-2-8-4(3)6/h1-2H,(H2,6,7,8)
(3) InChIKey: PKZMNMQCFNJXEH-UHFFFAOYAR

Product Name

5-fluoropyrimidin-4-amine

5-Fluoropyrimidin-4-amine Specification

Related Products

Hot Products