2-Chloroadenosine

2-Chloroadenosine is a chemical compound registered under number CAS 146-77-0, with the molecular formula C₁₀H₁₂ClN₅O₄, and a molar mass of 301.69 g/mol.

The molecule contains 32 atoms connected by 34 chemical bonds. The full systematic IUPAC name of this compound is (2R,3R,4S,5R)-2-(6-amino-2-chloropurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol. The interactive 3D model above lets you view the spatial arrangement of the atoms — you can rotate it with the mouse, zoom with the scroll wheel, and switch between skeletal / Ball & Stick / Space Fill visualization modes.

In terms of physicochemical properties, the partition coefficient logP = -0.1 (negative value, a hydrophilic compound), polar surface area PSA = 140 Ų, 4 donors and 8 hydrogen bond acceptors. These parameters are key when assessing bioavailability and interaction with biomolecules.

Chemical data for this compound comes from PubChem (NIH NLM NCBI), one of the world's largest chemical databases. All information is updated automatically and enriched with GHS hazard statement translations compliant with the CLP Regulation (EC 1272/2008). The widget above may be used for educational, research and commercial purposes.

Molecular formula	C10H12ClN5O4
Masa molowa	301.69 g/mol
IUPAC	(2R,3R,4S,5R)-2-(6-amino-2-chloropurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
SMILES	C1=NC2=C(N=C(N=C2N1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)Cl)N
InChIKey	BIXYYZIIJIXVFW-UUOKFMHZSA-N
logP (XLogP3)	-0.1
PSA	140 Ų
HBD / HBA	4 / 8
PubChem CID	CID 8974 ↗

Signal word: Danger

2-Chloroadenosine · 146-77-0 · ADENOSINE, 2-CHLORO- · 2-Chloroadenosinehemihydrate · 2 Chloroadenosine · 7W7ZUG45G8 · (2R,3R,4S,5R)-2-(6-amino-2-chloropurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol · NSC-36896 · RefChem:470363 · DTXCID301475316 · 205-678-3 · 6-Amino-2-chloropurine riboside · CADO · 5-Chloroformycin A · MFCD00005734

• 📊 PubChem CID 8974 — NIH
• 🔬 NIST WebBook — spektroskopia
• 🌐 Wikidata
• 💊 ChEMBL — bioaktywność