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4-Amino-1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-1-one structure
Fine Chemical

4-Amino-1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-1-one

TL;DR: 4-Amino-1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-1-one (CAS 116989-34-5) is a chemical compound with molecular formula C14H28N2O5 and molecular weight 304.19983 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-amino-1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-1-one

Also Known As: 4-amino-1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-1-one

CAS Number
116989-34-5
Molecular Formula
C14H28N2O5
Molecular Weight
304.19983 g/mol
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Technical Specifications

Molecular FormulaC14H28N2O5
Molecular Weight304.19983 g/mol
XLogP-1.7
Topological Polar Surface Area (TPSA)83.3 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors6
Rotatable Bonds3
Exact Mass304.19983 Da
Heavy Atoms21
Complexity250.0
SMILESC1COCCOCCOCCOCCN1C(=O)CCCN
InChIKeyWRJPUGULUKZNDM-UHFFFAOYSA-N

Chemical Property Profile of 4-Amino-1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-1-one

XLogP
-1.7
TPSA (Topological Polar Surface Area)
83.3
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
6
Rotatable Bonds
3
Heavy Atoms
21
Complexity
250.0
Exact Mass
304.19983
Monoisotopic Mass
304.19983
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 4-Amino-1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-1-one

The XLogP value of -1.7 indicates that 4-Amino-1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-1-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-1-one. Following Lipinski's Rule of Five, 4-Amino-1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-1-one has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 4-Amino-1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-1-one?

The CAS number of 4-Amino-1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-1-one is 116989-34-5.

What is the molecular formula of 4-Amino-1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-1-one?

The molecular formula of 4-Amino-1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-1-one is C14H28N2O5.

What is the molecular weight of 4-Amino-1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-1-one?

The molecular weight of 4-Amino-1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-1-one is 304.19983 g/mol.

Where can I buy 4-Amino-1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-1-one?

You can request a quote for 4-Amino-1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 4-Amino-1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-1-one?

Yes, CoreyChem provides custom synthesis services for 4-Amino-1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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