3,4-dihydro-2H-1,4-benzoxazin-2-ylmethanol
TL;DR: 3,4-dihydro-2H-1,4-benzoxazin-2-ylmethanol (CAS 82756-74-9) is a chemical compound with molecular formula C9H11NO2 and molecular weight 165.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dihydro-2H-1,4-benzoxazin-2-ylmethanol
Also Known As: 3,4-dihydro-2H-1,4-benzoxazin-2-ylmethanol, (3,4-Dihydro-2H-benzo[b][1,4]oxazin-2-yl)methanol, 5-Bromo-4-chloro-2-fluorotoluene, (3,4-dihydro-2H-1,4-benzoxazin-2-yl)methanol, SDCCGMLS-0066083.P001
| Molecular Formula | C9H11NO2 |
|---|---|
| Molecular Weight | 165.08 g/mol |
| LogP | 0.8518 |
| Topological Polar Surface Area | 41.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 165.07898 |
| Heavy Atoms | 12 |
| Complexity | 274.98596 |
Chemical Identifiers
| CAS Number | 82756-74-9 |
|---|---|
| SMILES | C1C(OC2=CC=CC=C2N1)CO |
Product Overview
3,4-dihydro-2H-1,4-benzoxazin-2-ylmethanol (CAS 82756-74-9), with molecular formula C9H11NO2 and molecular weight 165.08 g/mol. IUPAC: 3,4-dihydro-2H-1,4-benzoxazin-2-ylmethanol.
Chemical Property Profile of 3,4-dihydro-2H-1,4-benzoxazin-2-ylmethanol
Property Insights of 3,4-dihydro-2H-1,4-benzoxazin-2-ylmethanol
The XLogP value of 0.8518 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-dihydro-2H-1,4-benzoxazin-2-ylmethanol. With a topological polar surface area (TPSA) of 41.49 Ų, 3,4-dihydro-2H-1,4-benzoxazin-2-ylmethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-dihydro-2H-1,4-benzoxazin-2-ylmethanol 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 3,4-dihydro-2H-1,4-benzoxazin-2-ylmethanol?
The CAS number of 3,4-dihydro-2H-1,4-benzoxazin-2-ylmethanol is 82756-74-9.
What is the molecular formula of 3,4-dihydro-2H-1,4-benzoxazin-2-ylmethanol?
The molecular formula of 3,4-dihydro-2H-1,4-benzoxazin-2-ylmethanol is C9H11NO2.
What is the molecular weight of 3,4-dihydro-2H-1,4-benzoxazin-2-ylmethanol?
The molecular weight of 3,4-dihydro-2H-1,4-benzoxazin-2-ylmethanol is 165.08 g/mol.
Where can I buy 3,4-dihydro-2H-1,4-benzoxazin-2-ylmethanol?
You can request a quote for 3,4-dihydro-2H-1,4-benzoxazin-2-ylmethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-dihydro-2H-1,4-benzoxazin-2-ylmethanol?
Yes, KEHONG BIO provides custom synthesis services for 3,4-dihydro-2H-1,4-benzoxazin-2-ylmethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.