CAS No.56621-95-5,5-AMINO-2-FLUOROPYRIMIDINE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	56621-95-5
Name:	5-AMINO-2-FLUOROPYRIMIDINE

Formula:	C₄H₄FN₃
Molecular Weight:	113.094
Synonyms:	2-Fluoro-5-pyrimidinamine;2-fluoropyrimidin-5-amine;
Density:	1.373 g/cm³
Melting Point:	178-179 °C(Solv: benzene (71-43-2))
Boiling Point:	324.93 °C at 760 mmHg
Flash Point:	150.312 °C
PSA:	51.80000
LogP:	0.77910

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Specification

The CAS register number of 5-Pyrimidinamine,2-fluoro- is 56621-95-5. It also can be called as 2-Fluoro-5-pyrimidinamine and the systematic name about this chemical is 2-fluoropyrimidin-5-amine. The molecular formula about this chemical is C₄H₄FN₃ and the molecular weight is 113.09. It belongs to the Pyrimidine.

Physical properties about 5-Pyrimidinamine,2-fluoro- are: (1)ACD/BCF (pH 5.5): 1; (2)ACD/BCF (pH 7.4): 1; (3)ACD/KOC (pH 5.5): 15.638; (4)ACD/KOC (pH 7.4): 15.639; (5)#H bond acceptors: 3; (6)#H bond donors: 2; (7)#Freely Rotating Bonds: 1; (8)Polar Surface Area: 51.8Å²; (9)Index of Refraction: 1.561; (10)Molar Refractivity: 26.665 cm³; (11)Molar Volume: 82.371 cm³; (12)Polarizability: 10.571x10^-24cm³; (13)Surface Tension: 59.247 dyne/cm; (14)Flash Point: 150.312 °C; (15)Enthalpy of Vaporization: 56.7 kJ/mol; (16)Boiling Point: 324.93 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: c1c(cnc(n1)F)N
(2)InChI: InChI=1/C4H4FN3/c5-4-7-1-3(6)2-8-4/h1-2H,6H2
(3)InChIKey: LWQRIXAJNVYZEX-UHFFFAOYAD
(4)Std. InChI: InChI=1S/C4H4FN3/c5-4-7-1-3(6)2-8-4/h1-2H,6H2
(5)Std. InChIKey: LWQRIXAJNVYZEX-UHFFFAOYSA-N