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Bufotenin oxide structure
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Bufotenin oxide

TL;DR: Bufotenin oxide (CAS 1019-44-9) is a chemical compound with molecular formula C12H16N2O2 and molecular weight 220.12119 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-(5-hydroxy-1H-indol-3-yl)-N,N-dimethylethanamine oxide

Also Known As: Bufotenin oxide, Bufotenine oxide, BUFOTENINE, N-OXIDE, 1H-Indol-5-ol, 3-(2-(dimethylamino)ethyl)-, N-oxide, J2.250.319G

CAS Number
1019-44-9
Molecular Formula
C12H16N2O2
Molecular Weight
220.12119 g/mol
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Technical Specifications

Molecular FormulaC12H16N2O2
Molecular Weight220.12119 g/mol
XLogP0.6
Topological Polar Surface Area (TPSA)54.1 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors2
Rotatable Bonds3
Exact Mass220.12119 Da
Heavy Atoms16
Complexity245.0
SMILESC[N+](C)(CCC1=CNC2=C1C=C(C=C2)O)[O-]
InChIKeyUADOMBGQYQPICP-UHFFFAOYSA-N

Chemical Property Profile of Bufotenin oxide

XLogP
0.6
TPSA (Topological Polar Surface Area)
54.1
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
2
Rotatable Bonds
3
Heavy Atoms
16
Complexity
245.0
Exact Mass
220.12119
Monoisotopic Mass
220.12119
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 Bufotenin oxide

The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bufotenin oxide. With a topological polar surface area (TPSA) of 54.1 Ų, Bufotenin oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bufotenin oxide has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Bufotenin oxide?

The CAS number of Bufotenin oxide is 1019-44-9.

What is the molecular formula of Bufotenin oxide?

The molecular formula of Bufotenin oxide is C12H16N2O2.

What is the molecular weight of Bufotenin oxide?

The molecular weight of Bufotenin oxide is 220.12119 g/mol.

Where can I buy Bufotenin oxide?

You can request a quote for Bufotenin oxide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Bufotenin oxide?

Yes, CoreyChem provides custom synthesis services for Bufotenin oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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