2-Propanehydroperoxide, 1-bromo-3-chloro-2-phenyl-
TL;DR: 2-Propanehydroperoxide, 1-bromo-3-chloro-2-phenyl- (CAS 136749-71-8) is a chemical compound with molecular formula C9H10BrClO2 and molecular weight 263.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-bromo-3-chloro-2-hydroperoxypropan-2-yl)benzene
Also Known As: 2-Propanehydroperoxide, 1-bromo-3-chloro-2-phenyl-, (1-bromo-3-chloro-2-hydroperoxypropan-2-yl)benzene, 2-Bromo-1-(chloromethyl)-1-phenylethyl hydroperoxide, 2-Bromo-1-(chloromethyl)-1-phenylethyl hydroperoxide #
| Molecular Formula | C9H10BrClO2 |
|---|---|
| Molecular Weight | 263.96 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 263.95526 |
| Heavy Atoms | 13 |
| Complexity | 151.0 |
Chemical Identifiers
| CAS Number | 136749-71-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(CCl)(CBr)OO |
| InChIKey | ZTDDOVIMQPBFTF-UHFFFAOYSA-N |
Product Overview
2-Propanehydroperoxide, 1-bromo-3-chloro-2-phenyl- (CAS 136749-71-8), with molecular formula C9H10BrClO2 and molecular weight 263.96 g/mol. IUPAC: (1-bromo-3-chloro-2-hydroperoxypropan-2-yl)benzene.
Chemical Property Profile of 2-Propanehydroperoxide, 1-bromo-3-chloro-2-phenyl-
Property Insights of 2-Propanehydroperoxide, 1-bromo-3-chloro-2-phenyl-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propanehydroperoxide, 1-bromo-3-chloro-2-phenyl-. With a topological polar surface area (TPSA) of 29.5 Ų, 2-Propanehydroperoxide, 1-bromo-3-chloro-2-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propanehydroperoxide, 1-bromo-3-chloro-2-phenyl- 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 2-Propanehydroperoxide, 1-bromo-3-chloro-2-phenyl-?
The CAS number of 2-Propanehydroperoxide, 1-bromo-3-chloro-2-phenyl- is 136749-71-8.
What is the molecular formula of 2-Propanehydroperoxide, 1-bromo-3-chloro-2-phenyl-?
The molecular formula of 2-Propanehydroperoxide, 1-bromo-3-chloro-2-phenyl- is C9H10BrClO2.
What is the molecular weight of 2-Propanehydroperoxide, 1-bromo-3-chloro-2-phenyl-?
The molecular weight of 2-Propanehydroperoxide, 1-bromo-3-chloro-2-phenyl- is 263.96 g/mol.
Where can I buy 2-Propanehydroperoxide, 1-bromo-3-chloro-2-phenyl-?
You can request a quote for 2-Propanehydroperoxide, 1-bromo-3-chloro-2-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propanehydroperoxide, 1-bromo-3-chloro-2-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 2-Propanehydroperoxide, 1-bromo-3-chloro-2-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.