Rhodamine 101 inner salt
TL;DR: Rhodamine 101 inner salt (CAS 64339-18-0) is a chemical compound with molecular formula C32H30N2O3 and molecular weight 490.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-oxa-23-aza-9-azoniaheptacyclo[17.7.1.15,9.02,17.04,15.023,27.013,28]octacosa-1(27),2(17),4,9(28),13,15,18-heptaen-16-yl)benzoate
Also Known As: Rhodamine 101 inner salt, Rhodamine 101, Rhodamine 640, Rhodamine101innersalt, 3-Phenyl-4-amino-butanol
| Molecular Formula | C32H30N2O3 |
|---|---|
| Molecular Weight | 490.23 g/mol |
| LogP | 2.4854 |
| Topological Polar Surface Area | 55.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 490.22565 |
| Heavy Atoms | 37 |
| Complexity | 1645.648 |
Chemical Identifiers
| CAS Number | 64339-18-0 |
|---|---|
| SMILES | C1CC2=CC3=C(C4=C2N(C1)CCC4)OC5=C6CCC[N+]7=C6C(=CC5=C3C8=CC=CC=C8C(=O)[O-])CCC7 |
Product Overview
Rhodamine 101 inner salt (CAS 64339-18-0), with molecular formula C32H30N2O3 and molecular weight 490.23 g/mol. IUPAC: 2-(3-oxa-23-aza-9-azoniaheptacyclo[17.7.1.15,9.02,17.04,15.023,27.013,28]octacosa-1(27),2(17),4,9(28),13,15,18-heptaen-16-yl)benzoate.
Chemical Property Profile of Rhodamine 101 inner salt
Property Insights of Rhodamine 101 inner salt
The XLogP value of 2.4854 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Rhodamine 101 inner salt. With a topological polar surface area (TPSA) of 55.61 Ų, Rhodamine 101 inner salt exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Rhodamine 101 inner salt has 0 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 Rhodamine 101 inner salt?
The CAS number of Rhodamine 101 inner salt is 64339-18-0.
What is the molecular formula of Rhodamine 101 inner salt?
The molecular formula of Rhodamine 101 inner salt is C32H30N2O3.
What is the molecular weight of Rhodamine 101 inner salt?
The molecular weight of Rhodamine 101 inner salt is 490.23 g/mol.
Where can I buy Rhodamine 101 inner salt?
You can request a quote for Rhodamine 101 inner salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Rhodamine 101 inner salt?
Yes, KEHONG BIO provides custom synthesis services for Rhodamine 101 inner salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.