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RefChem:188178 structure
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RefChem:188178

TL;DR: RefChem:188178 (CAS 100642-98-6) is a chemical compound with molecular formula C64H111N9O12 and molecular weight 1197.8352 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

benzyl (2S)-4-methyl-2-[[(2S)-4-methyl-2-[[(2S)-4-methyl-2-[[(2S)-4-methyl-2-[[2-methyl-2-[[(2S)-4-methyl-2-[[(2S)-4-methyl-2-[[(2S)-4-methyl-2-[[(2S)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]pentanoyl]amino]pentanoyl]amino]pentanoyl]amino]propanoyl]amino]pentanoyl]amino]pentanoyl]amino]pentanoyl]amino]pentanoate

Also Known As: Boc-leu(4)-aib-leu(4)-obzl, Boc-Leu4-Aib-Leu4-OBzl, Boc-L-Leu4-Aib-L-Leu4-OBzl, J1.278.340J, benzyl (2S)-4-methyl-2-[[(2S)-4-methyl-2-[[(2S)-4-methyl-2-[[(2S)-4-methyl-2-[[2-methyl-2-[[(2S)-4-methyl-2-[[(2S)-4-methyl-2-[[(2S)-4-methyl-2-[[(2S)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]pentanoyl]amino]pentanoyl]amino]pentanoyl]amino]propanoyl]amino]pentanoyl]amino]pentanoyl]amino]pentanoyl]amino]pentanoate

CAS Number
100642-98-6
Molecular Formula
C64H111N9O12
Molecular Weight
1197.8352 g/mol
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Technical Specifications

Molecular FormulaC64H111N9O12
Molecular Weight1197.8352 g/mol
XLogP11.5
Topological Polar Surface Area (TPSA)297.0 Ų
Hydrogen Bond Donors9
Hydrogen Bond Acceptors12
Rotatable Bonds39
Exact Mass1197.8352 Da
Heavy Atoms85
Complexity2150.0
SMILESCC(C)C[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)NC(C)(C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)OCC1=CC=CC=C1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C
InChIKeyDHMCTWRJCOUSDE-XKIFMCPMSA-N

Product Description

Applications: RefChem:188178 is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies RefChem:188178 (CAS 100642-98-6) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

A fine chemical supplied by CoreyChem, RefChem:188178 (CAS 100642-98-6) has the molecular formula C64H111N9O12 and a molecular weight of 1197.84 g/mol. It is also known as Boc-leu(4)-aib-leu(4)-obzl and Boc-Leu4-Aib-Leu4-OBzl.

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 RefChem:188178

XLogP
11.5
TPSA (Topological Polar Surface Area)
297.0
Hydrogen Bond Donors
9
Hydrogen Bond Acceptors
12
Rotatable Bonds
39
Heavy Atoms
85
Complexity
2150.0
Exact Mass
1197.8352
Monoisotopic Mass
1197.8352
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:188178

The XLogP value of 11.5 indicates that RefChem:188178 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 297.0 Ų indicates high polarity, suggesting RefChem:188178 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:188178 has 9 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of RefChem:188178?

The CAS number of RefChem:188178 is 100642-98-6.

What is the molecular formula of RefChem:188178?

The molecular formula of RefChem:188178 is C64H111N9O12.

What is the molecular weight of RefChem:188178?

The molecular weight of RefChem:188178 is 1197.8352 g/mol.

What are the applications of RefChem:188178?

RefChem:188178 is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies RefChem:188178 (CAS 100642-98-6) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and...

Where can I buy RefChem:188178?

You can request a quote for RefChem:188178 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for RefChem:188178?

Yes, CoreyChem provides custom synthesis services for RefChem:188178 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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