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BRUCINE structure
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BRUCINE

TL;DR: BRUCINE (CAS 357-57-3) is a chemical compound with molecular formula C23H26N2O4 and molecular weight 394.18927 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(4aR,5aS,8aR,15bR)-10,11-dimethoxy-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-14-one

Also Known As: BRUCINE, Brucinum, Bruzin, Brucine sulfate, Brucine alkaloid

CAS Number
357-57-3
Molecular Formula
C23H26N2O4
Molecular Weight
394.18927 g/mol
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Technical Specifications

Molecular FormulaC23H26N2O4
Molecular Weight394.18927 g/mol
XLogP1.0
Topological Polar Surface Area (TPSA)51.2 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors5
Rotatable Bonds2
Exact Mass394.18927 Da
Heavy Atoms29
Complexity785.0
SMILESCOC1=C(C=C2C(=C1)[C@]34CCN5[C@H]3C[C@@H]6[C@@H]7C4N2C(=O)CC7OCC=C6C5)OC
InChIKeyRRKTZKIUPZVBMF-PLNGPGDESA-N

Product Description

Applications: BRUCINE is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies BRUCINE (CAS 357-57-3) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

BRUCINE (CAS 357-57-3) is a fine chemical with the molecular formula C23H26N2O4 and a molecular weight of 394.19 g/mol. It is also known as BRUCINE and Brucinum.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of BRUCINE

XLogP
1.0
TPSA (Topological Polar Surface Area)
51.2
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
5
Rotatable Bonds
2
Heavy Atoms
29
Complexity
785.0
Exact Mass
394.18927
Monoisotopic Mass
394.18927
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 BRUCINE

The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BRUCINE. With a topological polar surface area (TPSA) of 51.2 Ų, BRUCINE exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BRUCINE 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 BRUCINE?

The CAS number of BRUCINE is 357-57-3.

What is the molecular formula of BRUCINE?

The molecular formula of BRUCINE is C23H26N2O4.

What is the molecular weight of BRUCINE?

The molecular weight of BRUCINE is 394.18927 g/mol.

What are the applications of BRUCINE?

BRUCINE is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies BRUCINE (CAS 357-57-3) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

Where can I buy BRUCINE?

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

Does CoreyChem offer custom synthesis for BRUCINE?

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

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