5-溴-2-(十二烷氧基)苯甲酸
TL;DR: 5-溴-2-(十二烷氧基)苯甲酸 (CAS 62176-21-0) is a chemical compound with molecular formula C19H29BrO3 and molecular weight 384.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-溴-2-(十二烷氧基)苯甲酸
5-bromo-2-dodecoxybenzoic acid
Also Known As: 5-Bromo-2-(dodecyloxy)benzoic acid, 5-bromo-2-dodecoxybenzoic acid, 669-033-1, RefChem:301566
| Molecular Formula | C19H29BrO3 |
|---|---|
| Molecular Weight | 384.13 g/mol |
| LogP | 7.8 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 13 |
| Exact Mass | 384.13 |
| Heavy Atoms | 23 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 62176-21-0 |
|---|---|
| SMILES | CCCCCCCCCCCCOC1=C(C=C(C=C1)Br)C(=O)O |
| InChIKey | CPEOGJUTJBLENM-UHFFFAOYSA-N |
Product Overview
5-溴-2-(十二烷氧基)苯甲酸 (CAS 62176-21-0), with molecular formula C19H29BrO3 and molecular weight 384.13 g/mol. IUPAC: 5-bromo-2-dodecoxybenzoic acid.
Chemical Property Profile of 5-溴-2-(十二烷氧基)苯甲酸
Property Insights of 5-溴-2-(十二烷氧基)苯甲酸
The XLogP value of 7.8 indicates that 5-溴-2-(十二烷氧基)苯甲酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 5-溴-2-(十二烷氧基)苯甲酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-溴-2-(十二烷氧基)苯甲酸 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-溴-2-(十二烷氧基)苯甲酸?
The CAS number of 5-溴-2-(十二烷氧基)苯甲酸 is 62176-21-0.
What is the molecular formula of 5-溴-2-(十二烷氧基)苯甲酸?
The molecular formula of 5-溴-2-(十二烷氧基)苯甲酸 is C19H29BrO3.
What is the molecular weight of 5-溴-2-(十二烷氧基)苯甲酸?
The molecular weight of 5-溴-2-(十二烷氧基)苯甲酸 is 384.13 g/mol.
Where can I buy 5-溴-2-(十二烷氧基)苯甲酸?
You can request a quote for 5-溴-2-(十二烷氧基)苯甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-溴-2-(十二烷氧基)苯甲酸?
Yes, KEHONG BIO provides custom synthesis services for 5-溴-2-(十二烷氧基)苯甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.