Butanoic acid, 3-amino-4-oxo-, (3S)-
TL;DR: Butanoic acid, 3-amino-4-oxo-, (3S)- (CAS 21653-98-5) is a chemical compound with molecular formula C4H7NO3 and molecular weight 117.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-3-amino-4-oxobutanoic acid
Also Known As: aspartic aldehyde, aspartic acid, (3S)-3-amino-4-oxobutanoic acid, (S)-3-Formyl-beta-alanine, Succinaldehydic acid, 3-amino-, L-
| Molecular Formula | C4H7NO3 |
|---|---|
| Molecular Weight | 117.04 g/mol |
| LogP | -1.0127 |
| Topological Polar Surface Area | 80.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 117.042595 |
| Heavy Atoms | 8 |
| Complexity | 101.45654 |
Chemical Identifiers
| CAS Number | 21653-98-5 |
|---|---|
| SMILES | C([C@@H](C=O)N)C(=O)O |
Product Overview
Butanoic acid, 3-amino-4-oxo-, (3S)- (CAS 21653-98-5), with molecular formula C4H7NO3 and molecular weight 117.04 g/mol. IUPAC: (3S)-3-amino-4-oxobutanoic acid.
Chemical Property Profile of Butanoic acid, 3-amino-4-oxo-, (3S)-
Property Insights of Butanoic acid, 3-amino-4-oxo-, (3S)-
The XLogP value of -1.0127 indicates that Butanoic acid, 3-amino-4-oxo-, (3S)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 80.39 Ų falls within the moderate polarity range, balancing permeability and solubility for Butanoic acid, 3-amino-4-oxo-, (3S)-. Following Lipinski's Rule of Five, Butanoic acid, 3-amino-4-oxo-, (3S)- has 2 hydrogen bond donor(s) and 3 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 Butanoic acid, 3-amino-4-oxo-, (3S)-?
The CAS number of Butanoic acid, 3-amino-4-oxo-, (3S)- is 21653-98-5.
What is the molecular formula of Butanoic acid, 3-amino-4-oxo-, (3S)-?
The molecular formula of Butanoic acid, 3-amino-4-oxo-, (3S)- is C4H7NO3.
What is the molecular weight of Butanoic acid, 3-amino-4-oxo-, (3S)-?
The molecular weight of Butanoic acid, 3-amino-4-oxo-, (3S)- is 117.04 g/mol.
Where can I buy Butanoic acid, 3-amino-4-oxo-, (3S)-?
You can request a quote for Butanoic acid, 3-amino-4-oxo-, (3S)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butanoic acid, 3-amino-4-oxo-, (3S)-?
Yes, KEHONG BIO provides custom synthesis services for Butanoic acid, 3-amino-4-oxo-, (3S)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.