Benzene, 1,3-dimethyl-2-nitroso-
TL;DR: Benzene, 1,3-dimethyl-2-nitroso- (CAS 19519-71-2) is a chemical compound with molecular formula C8H9NO and molecular weight 135.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-2-nitrosobenzene
Also Known As: 1,3-Dimethyl-2-nitrosobenzene, Benzene, 1,3-dimethyl-2-nitroso-, m-Xylene, 2-nitroso-, 4-nitroso-3,5-xylene, 2,6-dimethylnitrosobenzene
| Molecular Formula | C8H9NO |
|---|---|
| Molecular Weight | 135.07 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 29.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 135.06842 |
| Heavy Atoms | 10 |
| Complexity | 114.0 |
Chemical Identifiers
| CAS Number | 19519-71-2 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)N=O |
| InChIKey | OFQRRUGDGASXKM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzene, 1,3-dimethyl-2-nitroso- (CAS 19519-71-2), with molecular formula C8H9NO and molecular weight 135.07 g/mol. IUPAC: 1,3-dimethyl-2-nitrosobenzene.
Chemical Property Profile of Benzene, 1,3-dimethyl-2-nitroso-
Property Insights of Benzene, 1,3-dimethyl-2-nitroso-
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzene, 1,3-dimethyl-2-nitroso-. With a topological polar surface area (TPSA) of 29.4 Ų, Benzene, 1,3-dimethyl-2-nitroso- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1,3-dimethyl-2-nitroso- has 0 hydrogen bond donor(s) and 2 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 Benzene, 1,3-dimethyl-2-nitroso-?
The CAS number of Benzene, 1,3-dimethyl-2-nitroso- is 19519-71-2.
What is the molecular formula of Benzene, 1,3-dimethyl-2-nitroso-?
The molecular formula of Benzene, 1,3-dimethyl-2-nitroso- is C8H9NO.
What is the molecular weight of Benzene, 1,3-dimethyl-2-nitroso-?
The molecular weight of Benzene, 1,3-dimethyl-2-nitroso- is 135.07 g/mol.
Where can I buy Benzene, 1,3-dimethyl-2-nitroso-?
You can request a quote for Benzene, 1,3-dimethyl-2-nitroso- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1,3-dimethyl-2-nitroso-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1,3-dimethyl-2-nitroso- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.