3-hydroxyphenyl-3H-diazirine
TL;DR: 3-hydroxyphenyl-3H-diazirine (CAS 81109-91-3) is a chemical compound with molecular formula C7H6N2O and molecular weight 134.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3H-diazirin-3-yl)phenol
Also Known As: 3-(3H-diazirin-3-yl)phenol, MHPDA, 3-Hydroxyphenyl-3H-diazirine, 3-(3-Diazirinyl)phenyl, 3-(3-Diazirinyl)phenol
| Molecular Formula | C7H6N2O |
|---|---|
| Molecular Weight | 134.05 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 45.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 134.04802 |
| Heavy Atoms | 10 |
| Complexity | 152.0 |
Chemical Identifiers
| CAS Number | 81109-91-3 |
|---|---|
| SMILES | C1=CC(=CC(=C1)O)C2N=N2 |
| InChIKey | MWZWCPZDSXFZKF-UHFFFAOYSA-N |
Product Overview
3-hydroxyphenyl-3H-diazirine (CAS 81109-91-3), with molecular formula C7H6N2O and molecular weight 134.05 g/mol. IUPAC: 3-(3H-diazirin-3-yl)phenol.
Chemical Property Profile of 3-hydroxyphenyl-3H-diazirine
Property Insights of 3-hydroxyphenyl-3H-diazirine
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-hydroxyphenyl-3H-diazirine. With a topological polar surface area (TPSA) of 45.0 Ų, 3-hydroxyphenyl-3H-diazirine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-hydroxyphenyl-3H-diazirine has 1 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-hydroxyphenyl-3H-diazirine?
The CAS number of 3-hydroxyphenyl-3H-diazirine is 81109-91-3.
What is the molecular formula of 3-hydroxyphenyl-3H-diazirine?
The molecular formula of 3-hydroxyphenyl-3H-diazirine is C7H6N2O.
What is the molecular weight of 3-hydroxyphenyl-3H-diazirine?
The molecular weight of 3-hydroxyphenyl-3H-diazirine is 134.05 g/mol.
Where can I buy 3-hydroxyphenyl-3H-diazirine?
You can request a quote for 3-hydroxyphenyl-3H-diazirine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-hydroxyphenyl-3H-diazirine?
Yes, KEHONG BIO provides custom synthesis services for 3-hydroxyphenyl-3H-diazirine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.