Butanoic acid, 4-oxo-4-(phenylamino)-, compd. with morpholine (1:1)
TL;DR: Butanoic acid, 4-oxo-4-(phenylamino)-, compd. with morpholine (1:1) (CAS 112997-58-7) is a chemical compound with molecular formula C14H20N2O4 and molecular weight 280.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-anilino-4-oxobutanoate;morpholin-4-ium
Also Known As: Succinanilic acid compd. with morpholine (1:1), Morpholin-4-ium 4-anilino-4-oxobutanoate, 4-anilino-4-oxobutanoate; morpholin-4-ium, 4-Oxo-4-(phenylamino)butanoic acid compd. with morpholine (1:1), BUTANOIC ACID, 4-OXO-4-(PHENYLAMINO)-, compd. with MORPHOLINE (1:1)
| Molecular Formula | C14H20N2O4 |
|---|---|
| Molecular Weight | 280.14 g/mol |
| LogP | -1.26 |
| Topological Polar Surface Area | 95.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 280.1423 |
| Heavy Atoms | 20 |
| Complexity | 238.0 |
Chemical Identifiers
| CAS Number | 112997-58-7 |
|---|---|
| SMILES | C1COCC[NH2+]1.C1=CC=C(C=C1)NC(=O)CCC(=O)[O-] |
| InChIKey | CXHAOZRPPXRMJG-UHFFFAOYSA-N |
Product Overview
Butanoic acid, 4-oxo-4-(phenylamino)-, compd. with morpholine (1:1) (CAS 112997-58-7), with molecular formula C14H20N2O4 and molecular weight 280.14 g/mol. IUPAC: 4-anilino-4-oxobutanoate;morpholin-4-ium.
Chemical Property Profile of Butanoic acid, 4-oxo-4-(phenylamino)-, compd. with morpholine (1:1)
Property Insights of Butanoic acid, 4-oxo-4-(phenylamino)-, compd. with morpholine (1:1)
The XLogP value of -1.26 indicates that Butanoic acid, 4-oxo-4-(phenylamino)-, compd. with morpholine (1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 95.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Butanoic acid, 4-oxo-4-(phenylamino)-, compd. with morpholine (1:1). Following Lipinski's Rule of Five, Butanoic acid, 4-oxo-4-(phenylamino)-, compd. with morpholine (1:1) has 2 hydrogen bond donor(s) and 4 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, 4-oxo-4-(phenylamino)-, compd. with morpholine (1:1)?
The CAS number of Butanoic acid, 4-oxo-4-(phenylamino)-, compd. with morpholine (1:1) is 112997-58-7.
What is the molecular formula of Butanoic acid, 4-oxo-4-(phenylamino)-, compd. with morpholine (1:1)?
The molecular formula of Butanoic acid, 4-oxo-4-(phenylamino)-, compd. with morpholine (1:1) is C14H20N2O4.
What is the molecular weight of Butanoic acid, 4-oxo-4-(phenylamino)-, compd. with morpholine (1:1)?
The molecular weight of Butanoic acid, 4-oxo-4-(phenylamino)-, compd. with morpholine (1:1) is 280.14 g/mol.
Where can I buy Butanoic acid, 4-oxo-4-(phenylamino)-, compd. with morpholine (1:1)?
You can request a quote for Butanoic acid, 4-oxo-4-(phenylamino)-, compd. with morpholine (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butanoic acid, 4-oxo-4-(phenylamino)-, compd. with morpholine (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Butanoic acid, 4-oxo-4-(phenylamino)-, compd. with morpholine (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.