邻苯二酚-3,6-双(亚甲基亚氨基二乙酸)
TL;DR: 邻苯二酚-3,6-双(亚甲基亚氨基二乙酸) (CAS 87707-11-7) is a chemical compound with molecular formula C16H20N2O10 and molecular weight 400.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
邻苯二酚-3,6-双(亚甲基亚氨基二乙酸)
2-[[4-[[bis(carboxymethyl)amino]methyl]-2,3-dihydroxyphenyl]methyl-(carboxymethyl)amino]acetic acid
Also Known As: Cbmida, Catecholamic acid, catechol-3,6-bis, Catechol-3,6-bis(methyleneiminodiacetic acid), Catechol-3,6-bis(methyliminodiacetic acid)
| Molecular Formula | C16H20N2O10 |
|---|---|
| Molecular Weight | 400.11 g/mol |
| LogP | -5.3 |
| Topological Polar Surface Area | 196.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 12 |
| Exact Mass | 400.1118 |
| Heavy Atoms | 28 |
| Complexity | 502.0 |
Chemical Identifiers
| CAS Number | 87707-11-7 |
|---|---|
| SMILES | C1=CC(=C(C(=C1CN(CC(=O)O)CC(=O)O)O)O)CN(CC(=O)O)CC(=O)O |
| InChIKey | CVKGUVNGXVVLRH-UHFFFAOYSA-N |
Product Overview
邻苯二酚-3,6-双(亚甲基亚氨基二乙酸) (CAS 87707-11-7), with molecular formula C16H20N2O10 and molecular weight 400.11 g/mol. IUPAC: 2-[[4-[[bis(carboxymethyl)amino]methyl]-2,3-dihydroxyphenyl]methyl-(carboxymethyl)amino]acetic acid.
Chemical Property Profile of 邻苯二酚-3,6-双(亚甲基亚氨基二乙酸)
Property Insights of 邻苯二酚-3,6-双(亚甲基亚氨基二乙酸)
The XLogP value of -5.3 indicates that 邻苯二酚-3,6-双(亚甲基亚氨基二乙酸) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 196.0 Ų indicates high polarity, suggesting 邻苯二酚-3,6-双(亚甲基亚氨基二乙酸) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 邻苯二酚-3,6-双(亚甲基亚氨基二乙酸) has 6 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 邻苯二酚-3,6-双(亚甲基亚氨基二乙酸)?
The CAS number of 邻苯二酚-3,6-双(亚甲基亚氨基二乙酸) is 87707-11-7.
What is the molecular formula of 邻苯二酚-3,6-双(亚甲基亚氨基二乙酸)?
The molecular formula of 邻苯二酚-3,6-双(亚甲基亚氨基二乙酸) is C16H20N2O10.
What is the molecular weight of 邻苯二酚-3,6-双(亚甲基亚氨基二乙酸)?
The molecular weight of 邻苯二酚-3,6-双(亚甲基亚氨基二乙酸) is 400.11 g/mol.
Where can I buy 邻苯二酚-3,6-双(亚甲基亚氨基二乙酸)?
You can request a quote for 邻苯二酚-3,6-双(亚甲基亚氨基二乙酸) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 邻苯二酚-3,6-双(亚甲基亚氨基二乙酸)?
Yes, KEHONG BIO provides custom synthesis services for 邻苯二酚-3,6-双(亚甲基亚氨基二乙酸) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.