Name: Name:Phosphonic acid, P-[[(1R)-2-(6-amino-9H-purin-9-yl)-1-methylethoxy]methyl]-, diethyl ester
Brand: Angene
SKU: AG002254
Rating: 90 (10 reviews)

Phosphonic acid, P-[[(1R)-2-(6-amino-9H-purin-9-yl)-1-methylethoxy]methyl]-, diethyl ester

CAS No.:

180587-75-1

Catalog Number:

AG002254

Molecular Formula:

C13H22N5O4P

Molecular Weight:

343.3186

Catalog Number:

AG002254

Chemical Name:

Phosphonic acid, P-[[(1R)-2-(6-amino-9H-purin-9-yl)-1-methylethoxy]methyl]-, diethyl ester

CAS Number:

180587-75-1

Molecular Formula:

C13H22N5O4P

Molecular Weight:

343.3186

MDL Number:

MFCD07369331

IUPAC Name:

9-[(2R)-2-(diethoxyphosphorylmethoxy)propyl]purin-6-amine

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

InChI Key:

GCOFRXOOFANVPB-SNVBAGLBSA-N

SMILES:

CCOP(=O)(CO[C@@H](Cn1cnc2c1ncnc2N)C)OCC

EC Number:

605-902-3

Complexity:

406

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

343.141g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

343.324g/mol

Monoisotopic Mass:

343.141g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

114A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.2