丹磺酸
TL;DR: 丹磺酸 (CAS 4272-77-9) is a chemical compound with molecular formula C12H13NO3S and molecular weight 251.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
丹磺酸
5-(dimethylamino)naphthalene-1-sulfonic acid
Also Known As: Dansyl acid, 5-(dimethylamino)naphthalene-1-sulfonic acid, DansylAcid, DansylAcid-d6, 5-Dimethylaminonaphthalene-1-sulfonic Acid
| Molecular Formula | C12H13NO3S |
|---|---|
| Molecular Weight | 251.06 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 66.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.06161 |
| Heavy Atoms | 17 |
| Complexity | 360.0 |
Chemical Identifiers
| CAS Number | 4272-77-9 |
|---|---|
| SMILES | CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)O |
| InChIKey | BBEQQKBWUHCIOU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
丹磺酸 (CAS 4272-77-9), with molecular formula C12H13NO3S and molecular weight 251.06 g/mol. IUPAC: 5-(dimethylamino)naphthalene-1-sulfonic acid.
Chemical Property Profile of 丹磺酸
Property Insights of 丹磺酸
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 丹磺酸. The TPSA of 66.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 丹磺酸. Following Lipinski's Rule of Five, 丹磺酸 has 1 hydrogen bond donor(s) and 4 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 丹磺酸?
The CAS number of 丹磺酸 is 4272-77-9.
What is the molecular formula of 丹磺酸?
The molecular formula of 丹磺酸 is C12H13NO3S.
What is the molecular weight of 丹磺酸?
The molecular weight of 丹磺酸 is 251.06 g/mol.
Where can I buy 丹磺酸?
You can request a quote for 丹磺酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 丹磺酸?
Yes, KEHONG BIO provides custom synthesis services for 丹磺酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.