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RefChem:1076759 structure
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RefChem:1076759

TL;DR: RefChem:1076759 (CAS 61043-00-3) is a chemical compound with molecular formula C10H20BrNO4 and molecular weight 297.05756 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

[(2S)-2-acetyloxy-4-methoxy-4-oxobutyl]-trimethylazanium bromide

Also Known As: L(-)-Azetylkarnitinmethylesterbromid, L(-)-Azetylkarnitinmethylesterbromid [German], Ammonium, (3-carboxy-2-hydroxypropyl)trimethyl-, bromide, methyl ester, acetate, (L)-, (L)-(3-Carboxy-2-hydroxypropyl)trimethylammonium bromide methyl ester acetate, [(2S)-2-acetyloxy-4-methoxy-4-oxobutyl]-trimethylazanium bromide

CAS Number
61043-00-3
Molecular Formula
C10H20BrNO4
Molecular Weight
297.05756 g/mol
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Technical Specifications

Molecular FormulaC10H20BrNO4
Molecular Weight297.05756 g/mol
XLogP-2.81
Topological Polar Surface Area (TPSA)52.6 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors5
Rotatable Bonds7
Exact Mass297.05756 Da
Heavy Atoms16
Complexity232.0
SMILESCC(=O)O[C@@H](CC(=O)OC)C[N+](C)(C)C.[Br-]
InChIKeyGBCPRKRBVFHBGT-FVGYRXGTSA-M

Chemical Property Profile of RefChem:1076759

XLogP
-2.81
TPSA (Topological Polar Surface Area)
52.6
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
5
Rotatable Bonds
7
Heavy Atoms
16
Complexity
232.0
Exact Mass
297.05756
Monoisotopic Mass
297.05756
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 RefChem:1076759

The XLogP value of -2.81 indicates that RefChem:1076759 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 52.6 Ų, RefChem:1076759 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1076759 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of RefChem:1076759?

The CAS number of RefChem:1076759 is 61043-00-3.

What is the molecular formula of RefChem:1076759?

The molecular formula of RefChem:1076759 is C10H20BrNO4.

What is the molecular weight of RefChem:1076759?

The molecular weight of RefChem:1076759 is 297.05756 g/mol.

Where can I buy RefChem:1076759?

You can request a quote for RefChem:1076759 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for RefChem:1076759?

Yes, CoreyChem provides custom synthesis services for RefChem:1076759 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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