Diethyl Tenofovir

CAT: 1299-RM-T140675-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-T140675-01Size:10 mg

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CAS Number

180587-75-1

Synonyms

Diethyl (R) - (((1- (6-amino-9H-purin-9-yl) propan-2-yl) oxy) methyl) phosphonate

Molecular Formula

C13H22N5O4P

Molecular Weight

343.33

Target Alternative Name

Tenofovir

Product Name Synonym

Diethyl (R) - (((1- (6-amino-9H-purin-9-yl) propan-2-yl) oxy) methyl) phosphonate

Chemical Information

Diethyl P-(((1R)-2-(6-amino-9H-purin-9-yl)-1-methylethoxy)methyl)phosphonate

CAS Number	180587-75-1
PubChem CID	10947889
IUPAC Name	9-[(2R)-2-(diethoxyphosphorylmethoxy)propyl]purin-6-amine
Molecular Formula	C13H22N5O4P
Molecular Weight	343.32
XLogP	0.2
Topological Polar Surface Area	114
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	9
Heavy Atom Count	23
Formal Charge	0
Complexity	406

SMILES

CCOP(=O)(CO[C@H](C)CN1C=NC2=C(N=CN=C21)N)OCC

InChI

InChI=1S/C13H22N5O4P/c1-4-21-23(19,22-5-2)9-20-10(3)6-18-8-17-11-12(14)15-7-16-13(11)18/h7-8,10H,4-6,9H2,1-3H3,(H2,14,15,16)/t10-/m1/s1

InChIKey

GCOFRXOOFANVPB-SNVBAGLBSA-N

Chemical Structure

2D Structure

CAS: 180587-75-1

CID: 10947889

Formula: C13H22N5O4P

MW: 343.32

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	343.32
XLogP3	0.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	9
Exact Mass	343.14094120
Monoisotopic Mass	343.14094120
Topological Polar Surface Area	114 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	406
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
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
RM-T140600-01	Tenofovir
RM-T140672-01	Tenofovir Trimer
RM-T140690-01	Rac Tenofovir
RM-T140685-01	Tenofovir Alafenamide
RM-T140630-01	Tenofovir Disoproxil Impurity 4 (Tenofovir Monomethyl Ester)
RM-T140629-01	Tenofovir Disoproxil Impurity 3 (6N-Hydroxymethyl Tenofovir Disoproxil)
RM-T140610-01	Tenofovir Disoproxil Impurity J; Mono-Poc Ethyl Tenofovir
RM-T140757-01	Tenofovir Impurity 157
RM-T140705-01	Tenofovir Impurity 105
RM-T140742-01	Tenofovir Impurity 142

Catalog	Name
AR-T01487-01	Diethyl Tenofovir
AR-T03479-01	Diethyl Tenofovir Fumarate Salt
sc-204335	Tenofovir