5-溴-3-甲基-2-(2-丙烯氧基)苯甲酰胺
TL;DR: 5-溴-3-甲基-2-(2-丙烯氧基)苯甲酰胺 (CAS 40912-97-8) is a chemical compound with molecular formula C11H12BrNO2 and molecular weight 269.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-溴-3-甲基-2-(2-丙烯氧基)苯甲酰胺
5-bromo-3-methyl-2-prop-2-enoxybenzamide
Also Known As: 5-Bromo-3-methyl-2-(2-propenyloxy)benzamide, 5-Brom-2-allyloxy-3-methyl-benzamid, BENZAMIDE, 5-BROMO-3-METHYL-2-(2-PROPENYLOXY)-, 5-bromo-3-methyl-2-prop-2-enoxybenzamide, 5-bromo-3-methyl-2-(prop-2-en-1-yloxy)benzamide
| Molecular Formula | C11H12BrNO2 |
|---|---|
| Molecular Weight | 269.01 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 269.00513 |
| Heavy Atoms | 15 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 40912-97-8 |
|---|---|
| SMILES | CC1=CC(=CC(=C1OCC=C)C(=O)N)Br |
| InChIKey | MPOKSWUQKCQSMM-UHFFFAOYSA-N |
Product Overview
5-溴-3-甲基-2-(2-丙烯氧基)苯甲酰胺 (CAS 40912-97-8), with molecular formula C11H12BrNO2 and molecular weight 269.01 g/mol. IUPAC: 5-bromo-3-methyl-2-prop-2-enoxybenzamide.
Chemical Property Profile of 5-溴-3-甲基-2-(2-丙烯氧基)苯甲酰胺
Property Insights of 5-溴-3-甲基-2-(2-丙烯氧基)苯甲酰胺
The XLogP value of 3.2 indicates that 5-溴-3-甲基-2-(2-丙烯氧基)苯甲酰胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.3 Ų, 5-溴-3-甲基-2-(2-丙烯氧基)苯甲酰胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-溴-3-甲基-2-(2-丙烯氧基)苯甲酰胺 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 5-溴-3-甲基-2-(2-丙烯氧基)苯甲酰胺?
The CAS number of 5-溴-3-甲基-2-(2-丙烯氧基)苯甲酰胺 is 40912-97-8.
What is the molecular formula of 5-溴-3-甲基-2-(2-丙烯氧基)苯甲酰胺?
The molecular formula of 5-溴-3-甲基-2-(2-丙烯氧基)苯甲酰胺 is C11H12BrNO2.
What is the molecular weight of 5-溴-3-甲基-2-(2-丙烯氧基)苯甲酰胺?
The molecular weight of 5-溴-3-甲基-2-(2-丙烯氧基)苯甲酰胺 is 269.01 g/mol.
Where can I buy 5-溴-3-甲基-2-(2-丙烯氧基)苯甲酰胺?
You can request a quote for 5-溴-3-甲基-2-(2-丙烯氧基)苯甲酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-溴-3-甲基-2-(2-丙烯氧基)苯甲酰胺?
Yes, KEHONG BIO provides custom synthesis services for 5-溴-3-甲基-2-(2-丙烯氧基)苯甲酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.