3',6'-Diaminospiro(isobenzofuran-1(3H),9'-(9H)xanthen)-3-one
TL;DR: 3',6'-Diaminospiro(isobenzofuran-1(3H),9'-(9H)xanthen)-3-one (CAS 509-72-8) is a chemical compound with molecular formula C20H14N2O3 and molecular weight 330.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3',6'-diaminospiro[2-benzofuran-3,9'-xanthene]-1-one
Also Known As: 3',6'-Diaminofluoran, Rhodamine, rhodamin, 3',6'-Fluorandiamine, Fluoran, 3',6'-diamino-
| Molecular Formula | C20H14N2O3 |
|---|---|
| Molecular Weight | 330.10 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 87.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 330.10043 |
| Heavy Atoms | 25 |
| Complexity | 527.0 |
Chemical Identifiers
| CAS Number | 509-72-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)OC23C4=C(C=C(C=C4)N)OC5=C3C=CC(=C5)N |
| InChIKey | ACNUVXZPCIABEX-UHFFFAOYSA-N |
Product Overview
3',6'-Diaminospiro(isobenzofuran-1(3H),9'-(9H)xanthen)-3-one (CAS 509-72-8), with molecular formula C20H14N2O3 and molecular weight 330.10 g/mol. IUPAC: 3',6'-diaminospiro[2-benzofuran-3,9'-xanthene]-1-one.
Chemical Property Profile of 3',6'-Diaminospiro(isobenzofuran-1(3H),9'-(9H)xanthen)-3-one
Property Insights of 3',6'-Diaminospiro(isobenzofuran-1(3H),9'-(9H)xanthen)-3-one
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3',6'-Diaminospiro(isobenzofuran-1(3H),9'-(9H)xanthen)-3-one. The TPSA of 87.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3',6'-Diaminospiro(isobenzofuran-1(3H),9'-(9H)xanthen)-3-one. Following Lipinski's Rule of Five, 3',6'-Diaminospiro(isobenzofuran-1(3H),9'-(9H)xanthen)-3-one has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3',6'-Diaminospiro(isobenzofuran-1(3H),9'-(9H)xanthen)-3-one?
The CAS number of 3',6'-Diaminospiro(isobenzofuran-1(3H),9'-(9H)xanthen)-3-one is 509-72-8.
What is the molecular formula of 3',6'-Diaminospiro(isobenzofuran-1(3H),9'-(9H)xanthen)-3-one?
The molecular formula of 3',6'-Diaminospiro(isobenzofuran-1(3H),9'-(9H)xanthen)-3-one is C20H14N2O3.
What is the molecular weight of 3',6'-Diaminospiro(isobenzofuran-1(3H),9'-(9H)xanthen)-3-one?
The molecular weight of 3',6'-Diaminospiro(isobenzofuran-1(3H),9'-(9H)xanthen)-3-one is 330.10 g/mol.
Where can I buy 3',6'-Diaminospiro(isobenzofuran-1(3H),9'-(9H)xanthen)-3-one?
You can request a quote for 3',6'-Diaminospiro(isobenzofuran-1(3H),9'-(9H)xanthen)-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3',6'-Diaminospiro(isobenzofuran-1(3H),9'-(9H)xanthen)-3-one?
Yes, KEHONG BIO provides custom synthesis services for 3',6'-Diaminospiro(isobenzofuran-1(3H),9'-(9H)xanthen)-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.