1H-2,3-Benzoxazine, 3,4-dihydro-7-chloro-
TL;DR: 1H-2,3-Benzoxazine, 3,4-dihydro-7-chloro- (CAS 21977-12-8) is a chemical compound with molecular formula C8H8ClNO and molecular weight 169.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-chloro-3,4-dihydro-1H-2,3-benzoxazine
Also Known As: 7-Chloro-3,4-dihydro-1H-2,3-benzoxazine, 1H-2,3-Benzoxazine, 7-chloro-3,4-dihydro-, 1H-2,3-BENZOXAZINE, 3,4-DIHYDRO-7-CHLORO-, 7-chloro-3,4-dihydro-1H-benzo[d][1,2]oxazine, 1H-2,3-BENZOXAZINE,3,4-DIHYDRO-7-CHLORO
| Molecular Formula | C8H8ClNO |
|---|---|
| Molecular Weight | 169.03 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 21.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 169.02943 |
| Heavy Atoms | 11 |
| Complexity | 142.0 |
Chemical Identifiers
| CAS Number | 21977-12-8 |
|---|---|
| SMILES | C1C2=C(CON1)C=C(C=C2)Cl |
| InChIKey | GQLHUUBKEQARIM-UHFFFAOYSA-N |
Product Overview
1H-2,3-Benzoxazine, 3,4-dihydro-7-chloro- (CAS 21977-12-8), with molecular formula C8H8ClNO and molecular weight 169.03 g/mol. IUPAC: 7-chloro-3,4-dihydro-1H-2,3-benzoxazine.
Chemical Property Profile of 1H-2,3-Benzoxazine, 3,4-dihydro-7-chloro-
Property Insights of 1H-2,3-Benzoxazine, 3,4-dihydro-7-chloro-
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-2,3-Benzoxazine, 3,4-dihydro-7-chloro-. With a topological polar surface area (TPSA) of 21.3 Ų, 1H-2,3-Benzoxazine, 3,4-dihydro-7-chloro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-2,3-Benzoxazine, 3,4-dihydro-7-chloro- 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 1H-2,3-Benzoxazine, 3,4-dihydro-7-chloro-?
The CAS number of 1H-2,3-Benzoxazine, 3,4-dihydro-7-chloro- is 21977-12-8.
What is the molecular formula of 1H-2,3-Benzoxazine, 3,4-dihydro-7-chloro-?
The molecular formula of 1H-2,3-Benzoxazine, 3,4-dihydro-7-chloro- is C8H8ClNO.
What is the molecular weight of 1H-2,3-Benzoxazine, 3,4-dihydro-7-chloro-?
The molecular weight of 1H-2,3-Benzoxazine, 3,4-dihydro-7-chloro- is 169.03 g/mol.
Where can I buy 1H-2,3-Benzoxazine, 3,4-dihydro-7-chloro-?
You can request a quote for 1H-2,3-Benzoxazine, 3,4-dihydro-7-chloro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-2,3-Benzoxazine, 3,4-dihydro-7-chloro-?
Yes, KEHONG BIO provides custom synthesis services for 1H-2,3-Benzoxazine, 3,4-dihydro-7-chloro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.