CAS No.56632-83-8,4-Amino-1-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-2(1H)-pyrimidinone Suppliers

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Basic Information

Molecular Structure:
CAS No.:	56632-83-8
Name:	4-Amino-1-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-2(1H)-pyrimidinone
Article Data:	6

Formula:	C₉H₁₂FN₃O₄
Molecular Weight:	245.21
Synonyms:	4-amino-1-[(2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one;4-Amino-1-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-2(1H)-pyrimidinone;2(1H)-Pyrimidinone, 4-amino-1-(2-deoxy-2-fluoro-β-D-arabinofuranosyl)-;4-Amino-1-(2-deoxy-2-fluoro--D-arabinofuranosyl)-2(1H)-pyrimidinone;1-(2-Deoxy-2-fluoro-b-D-arabinofuranosyl)cytosine;2-Fluoro-2-deoxy-arabinofuranosyl-cytidine;2-Deoxy-2-fluoro-beta-D-arabinocytidine;4-AMino-1-((2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxyMethyl)tetrahydrofuran-2-yl)pyriMidin-2(1H)-one
Density:	1.82 g/cm³
Melting Point:	136-138 °C
Boiling Point:	500.1 °C at 760 mmHg
Flash Point:	256.2 °C
PSA:	110.60000
LogP:	-1.00460

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Specification

The 4-Amino-1-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-2(1H)-pyrimidinone ,its cas register number is 56632-83-8.It also can be called as 4-Amino-1-[(2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one and the IUPAC name about this chemicals is 4-amino-1-[(2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one .

Following are the chemical properties about 4-Amino-1-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-2(1H)-pyrimidinone :(1)#H bond acceptors: 7 ; (2)#H bond donors: 4 ; (3)#Freely Rotating Bonds: 4 ; (4)Polar Surface Area: 63.6 Å² ; (5)Index of Refraction: 1.697 ; (6)Molar Refractivity: 51.66 cm³ ; (7)Molar Volume: 134 cm³ ; (8)Polarizability: 20.48x10^-24cm³ ; (9)Surface Tension: 71.3 dyne/cm ; (10)Enthalpy of Vaporization: 88.51 kJ/mol ; (11)Vapour Pressure: 4.27E-12 mmHg at 25°C

This chemicals can be described computed from structure:
(1)Canonical SMILES: C1=CN(C(=O)N=C1N)C2C(C(C(O2)CO)O)F
(2)Isomeric SMILES: C1=CN(C(=O)N=C1N)[C@H]2[C@H]([C@@H]([C@H](O2)CO)O)F
(3)InChI: InChI=1S/C9H12FN3O4/c10-6-7(15)4(3-14)17-8(6)13-2-1-5(11)12-9(13)16/h1-2,4,6-8,14-15H,3H2,(H2,11,12,16)/t4-,6+,7-,8-/m1/s1
(4)InChIKey: NVZFZMCNALTPBY-PXBUCIJWSA-N