3-氨基-2,2-二氟丁二酸
TL;DR: 3-氨基-2,2-二氟丁二酸 (CAS 756422-67-0) is a chemical compound with molecular formula C4H5F2NO4 and molecular weight 169.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-氨基-2,2-二氟丁二酸
3-amino-2,2-difluorobutanedioic acid
Also Known As: 3-amino-2,2-difluorobutanedioic acid, 3,3-difluoroaspartic acid, 3,3-Difluoro-D-aspartic acid, 3-amino-2,2-difluorobutanedioicacid, 3-Amino-2,2-difluoro-butanedioic acid
| Molecular Formula | C4H5F2NO4 |
|---|---|
| Molecular Weight | 169.02 g/mol |
| LogP | -3.1 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 169.01866 |
| Heavy Atoms | 11 |
| Complexity | 193.0 |
Chemical Identifiers
| CAS Number | 756422-67-0 |
|---|---|
| SMILES | C(C(=O)O)(C(C(=O)O)(F)F)N |
| InChIKey | ZDNZCAJNMQJPRB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-氨基-2,2-二氟丁二酸 (CAS 756422-67-0), with molecular formula C4H5F2NO4 and molecular weight 169.02 g/mol. IUPAC: 3-amino-2,2-difluorobutanedioic acid.
Chemical Property Profile of 3-氨基-2,2-二氟丁二酸
Property Insights of 3-氨基-2,2-二氟丁二酸
The XLogP value of -3.1 indicates that 3-氨基-2,2-二氟丁二酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-氨基-2,2-二氟丁二酸. Following Lipinski's Rule of Five, 3-氨基-2,2-二氟丁二酸 has 3 hydrogen bond donor(s) and 7 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 3-氨基-2,2-二氟丁二酸?
The CAS number of 3-氨基-2,2-二氟丁二酸 is 756422-67-0.
What is the molecular formula of 3-氨基-2,2-二氟丁二酸?
The molecular formula of 3-氨基-2,2-二氟丁二酸 is C4H5F2NO4.
What is the molecular weight of 3-氨基-2,2-二氟丁二酸?
The molecular weight of 3-氨基-2,2-二氟丁二酸 is 169.02 g/mol.
Where can I buy 3-氨基-2,2-二氟丁二酸?
You can request a quote for 3-氨基-2,2-二氟丁二酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-氨基-2,2-二氟丁二酸?
Yes, KEHONG BIO provides custom synthesis services for 3-氨基-2,2-二氟丁二酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.