2-amino-9-[(2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3H-purin-6-one

Basic Information

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CAS Number

103884-98-6

Molecular Formula

C10H12FN5O4

Molecular Weight

285.24 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Boiling Point

726.1°C at 760 mmHg

Density

2.17

Flash Point

392.9 ºC

Refractive Index

1.876

SMILES

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C1=NC2=C(N1C3C(C(C(O3)CO)O)F)N=C(NC2=O)N

InChI

InChI=1S/C10H12FN5O4/c11-4-6(18)3(1-17)20-9(4)16-2-13-5-7(16)14-10(12)15-8(5)19/h2-4,6,9,17-18H,1H2,(H3,12,14,15,19)/t3-,4+,6-,9-/m1/s1

InChIKey

UXUZARPLRQRNNX-AYQXTPAHSA-N

LogP

-1.7095

Topological Polar Surface Area

139.28 Å²

Hydrogen Bond Donor/Acceptor

5 / 9

Complexity

449

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

9-(2-Deoxy-2-fluoro-beta-D-arabinofuranosyl)guanine
AraF-G
2'-Fluoro-2'-deoxy-arabinofuranosyl-guanosine
F12899
2-amino-9-((3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-1,9-dihydro-6H-purin-6-one
9-(2'-Deoxy-2'-fluoro-b-D-arabinofuranosyl)guanine
2-amino-9-[(3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-6,9-dihydro-1H-purin-6-one
SCHEMBL21625241
A-D-[2'-Fluoro-2'-deoxy-arabinofuranosyl]guanine
A855630
2-AMINO-9-[(3S,4R,5R)-3-FLUORO-4-HYDROXY-5-(HYDROXYMETHYL)OXOLAN-2-YL]-1H-PURIN-6-ONE
9-(2-Deoxy-2-fluoropentofuranosyl)-2-imino-3,9-dihydro-2H-purin-6-ol
2-amino-9-[(3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one
DTXSID80908651
9-
MFCD01694134
103884-98-6
6H-Purin-6-one, 2-amino-9-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-1,9-dihydro-
BRN 4268484
9-(2-Deoxy-2-fluoroarabinofuranosyl)guanine
2-Amino-9-[(3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one
9-(2'-DEOXY-2'-FLUORO-B-D-ARABINOFURANOSYL)GUANINE
2-amino-9-(2-deoxy-2-fluoro-D-arabinofuranosyl)-3,9-dihydro-6H-purin-6-one
6H-Purin-6-one, 2-amino-9-(2-deoxy-2-fluoro-β-D-arabinofuranosyl)-1,9-dihydro-
9-β-D-[2'-Fluoro-2'-deoxy-arabinofuranosyl]-guanin
2'-Deoxy-2'-fluoro-beta-D-arabinoguanosine
9-β-D-[2'-Fluoro-2'-deoxy-arabinofuranosyl]-guanine
884A986
2-Amino-9-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-1H-purin-6(9H)-one
(+/-)-6H-Purin-6-one, 2-amino-1,9-dihydro-9-(2-deoxy-2-fluoro-.beta.-D-arabinofuranosyl)-
2-Amino-9-((2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-hydroxymethyltetrahydrofuran-2-yl)-1,9-dihydropurin-6-one