1,2-苯二(甲酸-14C)二丁酯
TL;DR: 1,2-苯二(甲酸-14C)二丁酯 (CAS 66851-47-6) is a chemical compound with molecular formula C16H22O4 and molecular weight 282.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-苯二(甲酸-14C)二丁酯
dibutyl benzene-1,2-dicarboxylate
Also Known As: dibutyl phthalate, dibutyl benzene-1,2-dicarboxylate, 1,2-Benzenedi(carboxylic-14C)acid, dibutyl ester, DIBUTYL PHTHALATE (CARBONYL-14C), Dibutyl benzene-1,2-(~14~C_2_)dicarboxylate
| Molecular Formula | C16H22O4 |
|---|---|
| Molecular Weight | 282.16 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 282.1583 |
| Heavy Atoms | 20 |
| Complexity | 271.0 |
Chemical Identifiers
| CAS Number | 66851-47-6 |
|---|---|
| SMILES | CCCCO[14C](=O)C1=CC=CC=C1[14C](=O)OCCCC |
| InChIKey | DOIRQSBPFJWKBE-IUWMYWAXSA-N |
Product Overview
1,2-苯二(甲酸-14C)二丁酯 (CAS 66851-47-6), with molecular formula C16H22O4 and molecular weight 282.16 g/mol. IUPAC: dibutyl benzene-1,2-dicarboxylate.
Chemical Property Profile of 1,2-苯二(甲酸-14C)二丁酯
Property Insights of 1,2-苯二(甲酸-14C)二丁酯
The XLogP value of 4.7 indicates that 1,2-苯二(甲酸-14C)二丁酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 1,2-苯二(甲酸-14C)二丁酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-苯二(甲酸-14C)二丁酯 has 0 hydrogen bond donor(s) and 4 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 1,2-苯二(甲酸-14C)二丁酯?
The CAS number of 1,2-苯二(甲酸-14C)二丁酯 is 66851-47-6.
What is the molecular formula of 1,2-苯二(甲酸-14C)二丁酯?
The molecular formula of 1,2-苯二(甲酸-14C)二丁酯 is C16H22O4.
What is the molecular weight of 1,2-苯二(甲酸-14C)二丁酯?
The molecular weight of 1,2-苯二(甲酸-14C)二丁酯 is 282.16 g/mol.
Where can I buy 1,2-苯二(甲酸-14C)二丁酯?
You can request a quote for 1,2-苯二(甲酸-14C)二丁酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-苯二(甲酸-14C)二丁酯?
Yes, KEHONG BIO provides custom synthesis services for 1,2-苯二(甲酸-14C)二丁酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.