2'-Deoxy-2'-fluoroadenosine

CAT: 0926-ND02827-02Size: 10 gDry Ice: NoHazardous: No

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CAT#:0926-ND02827-02Size:10 g

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CAS Number

64183-27-3

Synonyms

2'-Fluoro-2'-deoxy-D-adenosine;9- (2-Fluoro-2-deoxy-β-D-ribofuranosyI) -ad enine;2'-Deoxy-2'-fluoro-D-adenosine;2'-Fluoro-2'-deoxyadenosine

MDL Number

MFCD09750859

Smiles

C1=NC (=C2C (=N1) N (C=N2) [C@H]3[C@@H] ([C@@H] ([C@H] (O3) CO) O) F) N

Molecular Formula

C10H12FN5O3

Molecular Weight

269.24 g/mol

Controlled

Chemical Information

2'-Fluoro-2'-deoxyadenosine

CAS Number	64183-27-3
PubChem CID	100253
IUPAC Name	(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-4-fluoro-2-(hydroxymethyl)oxolan-3-ol
Molecular Formula	C10H12FN5O3
Molecular Weight	269.23
XLogP	0
Topological Polar Surface Area	119
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	2
Heavy Atom Count	19
Formal Charge	0
Complexity	338

SMILES

C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)F)N

InChI

InChI=1S/C10H12FN5O3/c11-5-7(18)4(1-17)19-10(5)16-3-15-6-8(12)13-2-14-9(6)16/h2-5,7,10,17-18H,1H2,(H2,12,13,14)/t4-,5-,7-,10-/m1/s1

InChIKey

ZGYYPTJWJBEXBC-QYYRPYCUSA-N

Chemical Structure

2D Structure

CAS: 64183-27-3

CID: 100253

Formula: C10H12FN5O3

MW: 269.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	269.23
XLogP3	0
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	2
Exact Mass	269.09241742
Monoisotopic Mass	269.09241742
Topological Polar Surface Area	119 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	338
Isotope Atom Count	0
Defined Atom Stereocenter Count	4
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
ND02602	2'-Deoxy-5-fluoroadenosine
ND29524-01	3'-Deoxy-2-fluoroadenosine
ND45638	2'-Deoxy-4'-ethynyl-2-fluoroadenosine
ND15616-01	3'-Deoxy-3'-fluoroadenosine
NF08852-01	2-Fluoroadenosine
NB08366-01	N6-Benzoyl-2'-deoxy-5'-O-DMT-2'-fluoroadenosine
NB61549-01	N6-Benzoyl-3'-deoxy-3'-fluoroadenosine
PB08393-01	N6-Benzoyl-2'-deoxy-5'-O-DMT-2'-fluoroadenosine 3'-CE phosphoramidite
NF77069-01	2-Fluoroadenosine 5'-triphosphate sodium
ND80474-01	2',3'-Dideoxy-3'-fluoroadenosine

Catalog	Name
B8924-100	2′-Deoxy-2′-fluoroadenosine
sc-283469	2'-Deoxy-2'-fluoroadenosine
296014-01	2'-Deoxy-2-fluoroadenosine
BIMN2005	2'-Amino-2'-deoxy-2-fluoroadenosine
295166-01	2-Amino-2'-deoxy-2'-fluoroadenosine
BIMN2010	2'-Deoxy-2'-fluoro-2-fluoroadenosine
TNU1584-01	8-Chloro-2'-deoxy-2'-fluoroadenosine
HY-154396	8-Chloro-2’-deoxy-2’-fluoroadenosine
295549-01	N6-Benzoyl-2'-deoxy-2'-fluoroadenosine
295912-01	2'-Deoxy-2'-fluoroadenosine-5'-triphosphate