Guanidine, (2,3-dihydro-7-methyl-3-benzofuranyl)-, nitrate
TL;DR: Guanidine, (2,3-dihydro-7-methyl-3-benzofuranyl)-, nitrate (CAS 3526-31-6) is a chemical compound with molecular formula C10H14N4O4 and molecular weight 254.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
carbamimidoyl-(7-methyl-2,3-dihydro-1-benzofuran-3-yl)azanium nitrate
Also Known As: SK&F 90238, N-(7-Methylcoumaran-3-yl)guanidine nitrate, (2,3-Dihydro-7-methyl-3-benzofuranyl)guanidine nitrate, GUANIDINE, (2,3-DIHYDRO-7-METHYL-3-BENZOFURANYL)-, NITRATE, carbamimidoyl-(7-methyl-2,3-dihydro-1-benzofuran-3-yl)azanium nitrate
| Molecular Formula | C10H14N4O4 |
|---|---|
| Molecular Weight | 254.10 g/mol |
| LogP | -0.35 |
| Topological Polar Surface Area | 139.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 254.1015 |
| Heavy Atoms | 18 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 3526-31-6 |
|---|---|
| SMILES | CC1=C2C(=CC=C1)C(CO2)[NH2+]C(=N)N.[N+](=O)([O-])[O-] |
| InChIKey | UIPRULKYMQYIQR-UHFFFAOYSA-O |
Product Overview
Guanidine, (2,3-dihydro-7-methyl-3-benzofuranyl)-, nitrate (CAS 3526-31-6), with molecular formula C10H14N4O4 and molecular weight 254.10 g/mol. IUPAC: carbamimidoyl-(7-methyl-2,3-dihydro-1-benzofuran-3-yl)azanium nitrate.
Chemical Property Profile of Guanidine, (2,3-dihydro-7-methyl-3-benzofuranyl)-, nitrate
Property Insights of Guanidine, (2,3-dihydro-7-methyl-3-benzofuranyl)-, nitrate
The XLogP value of -0.35 indicates that Guanidine, (2,3-dihydro-7-methyl-3-benzofuranyl)-, nitrate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 139.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Guanidine, (2,3-dihydro-7-methyl-3-benzofuranyl)-, nitrate. Following Lipinski's Rule of Five, Guanidine, (2,3-dihydro-7-methyl-3-benzofuranyl)-, nitrate has 3 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 Guanidine, (2,3-dihydro-7-methyl-3-benzofuranyl)-, nitrate?
The CAS number of Guanidine, (2,3-dihydro-7-methyl-3-benzofuranyl)-, nitrate is 3526-31-6.
What is the molecular formula of Guanidine, (2,3-dihydro-7-methyl-3-benzofuranyl)-, nitrate?
The molecular formula of Guanidine, (2,3-dihydro-7-methyl-3-benzofuranyl)-, nitrate is C10H14N4O4.
What is the molecular weight of Guanidine, (2,3-dihydro-7-methyl-3-benzofuranyl)-, nitrate?
The molecular weight of Guanidine, (2,3-dihydro-7-methyl-3-benzofuranyl)-, nitrate is 254.10 g/mol.
Where can I buy Guanidine, (2,3-dihydro-7-methyl-3-benzofuranyl)-, nitrate?
You can request a quote for Guanidine, (2,3-dihydro-7-methyl-3-benzofuranyl)-, nitrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Guanidine, (2,3-dihydro-7-methyl-3-benzofuranyl)-, nitrate?
Yes, KEHONG BIO provides custom synthesis services for Guanidine, (2,3-dihydro-7-methyl-3-benzofuranyl)-, nitrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.