4H-1,3-Benzoxazin-4-one, 2,3-dihydro-6-chloro-2-(2-chloroethyl)-
TL;DR: 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-6-chloro-2-(2-chloroethyl)- (CAS 1016-75-7) is a chemical compound with molecular formula C10H9Cl2NO2 and molecular weight 245.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-2-(2-chloroethyl)-2,3-dihydro-1,3-benzoxazin-4-one
Also Known As: 2,3-Dihydro-6-chloro-2-(2-chloroethyl)-4H-1,3-benzoxazin-4-one, 4H-1,3-BENZOXAZIN-4-ONE, 2,3-DIHYDRO-6-CHLORO-2-(2-CHLOROETHYL)-, 6-Chloro-2-(2-chloroethyl)-2H-1,3-benzoxazin-4-ol, 6-chloro-2-(2-chloroethyl)-2,3-dihydro-1,3-benzoxazin-4-one, 6-Chloro-2-(2-chloroethyl)-2H-1,3-benzoxazin-4(3H)-one
| Molecular Formula | C10H9Cl2NO2 |
|---|---|
| Molecular Weight | 245.00 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 245.00104 |
| Heavy Atoms | 15 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 1016-75-7 |
|---|---|
| SMILES | C1=CC2=C(C=C1Cl)C(=O)NC(O2)CCCl |
| InChIKey | UJNNEFOHOMFYDU-UHFFFAOYSA-N |
Product Overview
4H-1,3-Benzoxazin-4-one, 2,3-dihydro-6-chloro-2-(2-chloroethyl)- (CAS 1016-75-7), with molecular formula C10H9Cl2NO2 and molecular weight 245.00 g/mol. IUPAC: 6-chloro-2-(2-chloroethyl)-2,3-dihydro-1,3-benzoxazin-4-one.
Chemical Property Profile of 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-6-chloro-2-(2-chloroethyl)-
Property Insights of 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-6-chloro-2-(2-chloroethyl)-
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-6-chloro-2-(2-chloroethyl)-. With a topological polar surface area (TPSA) of 38.3 Ų, 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-6-chloro-2-(2-chloroethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-6-chloro-2-(2-chloroethyl)- has 1 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 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-6-chloro-2-(2-chloroethyl)-?
The CAS number of 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-6-chloro-2-(2-chloroethyl)- is 1016-75-7.
What is the molecular formula of 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-6-chloro-2-(2-chloroethyl)-?
The molecular formula of 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-6-chloro-2-(2-chloroethyl)- is C10H9Cl2NO2.
What is the molecular weight of 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-6-chloro-2-(2-chloroethyl)-?
The molecular weight of 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-6-chloro-2-(2-chloroethyl)- is 245.00 g/mol.
Where can I buy 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-6-chloro-2-(2-chloroethyl)-?
You can request a quote for 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-6-chloro-2-(2-chloroethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-6-chloro-2-(2-chloroethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-6-chloro-2-(2-chloroethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.