(2-Methyl-3-nitrophenyl)thiourea
TL;DR: (2-Methyl-3-nitrophenyl)thiourea (CAS 691884-60-3) is a chemical compound with molecular formula C8H9N3O2S and molecular weight 211.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methyl-3-nitrophenyl)thiourea
Also Known As: (2-methyl-3-nitrophenyl)thiourea, N-(2-methyl-3-nitrophenyl)thiourea, (2-methyl-3-nitro-phenyl)thiourea, 4P-063
| Molecular Formula | C8H9N3O2S |
|---|---|
| Molecular Weight | 211.04 g/mol |
| LogP | 1.55872 |
| Topological Polar Surface Area | 81.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 211.04155 |
| Heavy Atoms | 14 |
| Complexity | 392.17282 |
Chemical Identifiers
| CAS Number | 691884-60-3 |
|---|---|
| SMILES | CC1=C(C=CC=C1[N+](=O)[O-])NC(=S)N |
Product Overview
(2-Methyl-3-nitrophenyl)thiourea (CAS 691884-60-3), with molecular formula C8H9N3O2S and molecular weight 211.04 g/mol. IUPAC: (2-methyl-3-nitrophenyl)thiourea.
Chemical Property Profile of (2-Methyl-3-nitrophenyl)thiourea
Property Insights of (2-Methyl-3-nitrophenyl)thiourea
The XLogP value of 1.55872 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Methyl-3-nitrophenyl)thiourea. The TPSA of 81.19 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-Methyl-3-nitrophenyl)thiourea. Following Lipinski's Rule of Five, (2-Methyl-3-nitrophenyl)thiourea has 2 hydrogen bond donor(s) and 3 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 (2-Methyl-3-nitrophenyl)thiourea?
The CAS number of (2-Methyl-3-nitrophenyl)thiourea is 691884-60-3.
What is the molecular formula of (2-Methyl-3-nitrophenyl)thiourea?
The molecular formula of (2-Methyl-3-nitrophenyl)thiourea is C8H9N3O2S.
What is the molecular weight of (2-Methyl-3-nitrophenyl)thiourea?
The molecular weight of (2-Methyl-3-nitrophenyl)thiourea is 211.04 g/mol.
Where can I buy (2-Methyl-3-nitrophenyl)thiourea?
You can request a quote for (2-Methyl-3-nitrophenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Methyl-3-nitrophenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for (2-Methyl-3-nitrophenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.