4–((3aR,4R,6R,6aR)–6–(6–amino–8–bromopurin–9–yl)–2,2–dimethyl–tetrahydrofuro(3,4–d)(1,3)dioxol–4–ylmethoxymethyl)benzonitrile

cas: 1134156-53-8 — see every product listed under this CAS number, including other names

4–((3aR,4R,6R,6aR)–6–(6–amino–8–bromopurin–9–yl)–2,2–dimethyl–tetrahydrofuro(3,4–d)(1,3)dioxol–4–ylmethoxymethyl)benzonitrile (CAS 1134156-53-8) is a chemical reagent available from Chemat. Available pack sizes: 100mg, 1g, 250mg. Offered by: GLPBio.

• 2D
• 3D

4-[[(3aR,4R,6R,6aR)-4-(6-amino-8-bromopurin-9-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methoxymethyl]benzonitrile (CAS 1134156-53-8) is a chemical compound with the molecular formula C21H21BrN6O4 and a molecular weight of 501.3 g/mol. IUPAC name: 4-[[(3aR,4R,6R,6aR)-4-(6-amino-8-bromopurin-9-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methoxymethyl]benzonitrile. InChIKey: XSPCSNCZRVWYLT-NVQRDWNXSA-N.

Identity

Molecular formula	C21H21BrN6O4
Molecular weight	501.3 g/mol
IUPAC name	4-[[(3aR,4R,6R,6aR)-4-(6-amino-8-bromopurin-9-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methoxymethyl]benzonitrile
InChIKey	XSPCSNCZRVWYLT-NVQRDWNXSA-N
SMILES	CC1(O[C@@H]2[C@H](O[C@H]([C@@H]2O1)N3C4=NC=NC(=C4N=C3Br)N)COCC5=CC=C(C=C5)C#N)C

Computed by PubChem (NCBI)

Synonyms: 8-Bromo-5'-O-[(4-cyanophenyl)methyl]-2',3'-O-(1-methylethylidene)adenosine, 8-bromo-5'-o-(4-cyanobenzyl)-2',3'-o-isopropylidene adenosine, orb1908250, 8-Bromo-5'-O-(4-cyanobenzyl)-2',3'-di-O-isopropylidene adenosine, 8-Bromo-5??-O-(4-cyanobenzyl)-2??,3??-O-isopropylidene adenosine, 8-Bromo-5a?O-(4-cyanobenzyl)-2a?3a?di-O-isopropylidene adenosine

Isomers (same molecular formula)

methyl 4-[2-[(2,4-diaminopteridin-6-yl)methyl]-1-methoxy-1-oxopent-4-yn-2-yl]benzoate;hydrobromide C₂₁H₂₁BrN₆O₄