2-氨基-3-羧基粘康酸半醛
TL;DR: 2-氨基-3-羧基粘康酸半醛 (CAS 16597-58-3) is a chemical compound with molecular formula C7H7NO5 and molecular weight 185.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-氨基-3-羧基粘康酸半醛
2-amino-3-(3-oxoprop-1-enyl)but-2-enedioic acid
Also Known As: 2-amino-3-(3-oxoprop-1-enyl)but-2-enedioic acid, 2-amino-3-(3-oxoprop-1-en-1-yl)but-2-enedioic acid, 2-Amino-3-(3-oxo-1-propen-1-yl)-2-butenedioic acid, 1-amino-4-formyl-1,3-butadiene-1,2-dicarboxylic acid, 2-Butenedioic acid,2-amino-3-(3-oxo-1-propen-1-yl)-
| Molecular Formula | C7H7NO5 |
|---|---|
| Molecular Weight | 185.03 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 185.03242 |
| Heavy Atoms | 13 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 16597-58-3 |
|---|---|
| SMILES | C(=CC(=C(C(=O)O)N)C(=O)O)C=O |
| InChIKey | KACPVQQHDVBVFC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-氨基-3-羧基粘康酸半醛 (CAS 16597-58-3), with molecular formula C7H7NO5 and molecular weight 185.03 g/mol. IUPAC: 2-amino-3-(3-oxoprop-1-enyl)but-2-enedioic acid.
Chemical Property Profile of 2-氨基-3-羧基粘康酸半醛
Property Insights of 2-氨基-3-羧基粘康酸半醛
The XLogP value of -0.5 indicates that 2-氨基-3-羧基粘康酸半醛 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-氨基-3-羧基粘康酸半醛. Following Lipinski's Rule of Five, 2-氨基-3-羧基粘康酸半醛 has 3 hydrogen bond donor(s) and 6 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 2-氨基-3-羧基粘康酸半醛?
The CAS number of 2-氨基-3-羧基粘康酸半醛 is 16597-58-3.
What is the molecular formula of 2-氨基-3-羧基粘康酸半醛?
The molecular formula of 2-氨基-3-羧基粘康酸半醛 is C7H7NO5.
What is the molecular weight of 2-氨基-3-羧基粘康酸半醛?
The molecular weight of 2-氨基-3-羧基粘康酸半醛 is 185.03 g/mol.
Where can I buy 2-氨基-3-羧基粘康酸半醛?
You can request a quote for 2-氨基-3-羧基粘康酸半醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-氨基-3-羧基粘康酸半醛?
Yes, KEHONG BIO provides custom synthesis services for 2-氨基-3-羧基粘康酸半醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.