亚甲基二没食子酸
TL;DR: 亚甲基二没食子酸 (CAS 552-21-6) is a chemical compound with molecular formula C15H12O10 and molecular weight 352.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
亚甲基二没食子酸
2-[(6-carboxy-2,3,4-trihydroxyphenyl)methyl]-3,4,5-trihydroxybenzoic acid
Also Known As: Methylenedigallic acid, METHYLENEBISGALLIC ACID, METHYLENEDIGALLIC ACID [MI], 2,2'-methylenebis(3,4,5-trihydroxybenzoic acid), GALLIC ACID, 2,2'-METHYLENEDI-
| Molecular Formula | C15H12O10 |
|---|---|
| Molecular Weight | 352.04 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 196.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 352.04306 |
| Heavy Atoms | 25 |
| Complexity | 467.0 |
Chemical Identifiers
| CAS Number | 552-21-6 |
|---|---|
| SMILES | C1=C(C(=C(C(=C1O)O)O)CC2=C(C(=C(C=C2C(=O)O)O)O)O)C(=O)O |
| InChIKey | HEFYRPDDQCAYRU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
亚甲基二没食子酸 (CAS 552-21-6), with molecular formula C15H12O10 and molecular weight 352.04 g/mol. IUPAC: 2-[(6-carboxy-2,3,4-trihydroxyphenyl)methyl]-3,4,5-trihydroxybenzoic acid.
Chemical Property Profile of 亚甲基二没食子酸
Property Insights of 亚甲基二没食子酸
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 亚甲基二没食子酸. The TPSA of 196.0 Ų indicates high polarity, suggesting 亚甲基二没食子酸 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 亚甲基二没食子酸 has 8 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 亚甲基二没食子酸?
The CAS number of 亚甲基二没食子酸 is 552-21-6.
What is the molecular formula of 亚甲基二没食子酸?
The molecular formula of 亚甲基二没食子酸 is C15H12O10.
What is the molecular weight of 亚甲基二没食子酸?
The molecular weight of 亚甲基二没食子酸 is 352.04 g/mol.
Where can I buy 亚甲基二没食子酸?
You can request a quote for 亚甲基二没食子酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 亚甲基二没食子酸?
Yes, KEHONG BIO provides custom synthesis services for 亚甲基二没食子酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.