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3-{[(Tert-butoxy)carbonyl]amino}-5-(methylsulfanyl)pentanoic acid structure
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3-{[(Tert-butoxy)carbonyl]amino}-5-(methylsulfanyl)pentanoic acid

TL;DR: 3-{[(Tert-butoxy)carbonyl]amino}-5-(methylsulfanyl)pentanoic acid (CAS 1217811-51-2) is a chemical compound with molecular formula C11H21NO4S and molecular weight 263.11914 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-[(2-methylpropan-2-yl)oxycarbonylamino]-5-methylsulfanylpentanoic acid

Also Known As: Boc-beta-HoMet-OH, Boc-L-beta-homomethionine, Boc-beta-Homomet-OH, Boc-, A-Homomet-OH

CAS Number
1217811-51-2
Molecular Formula
C11H21NO4S
Molecular Weight
263.11914 g/mol
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Technical Specifications

Molecular FormulaC11H21NO4S
Molecular Weight263.11914 g/mol
XLogP1.5
Topological Polar Surface Area (TPSA)101.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors5
Rotatable Bonds8
Exact Mass263.11914 Da
Heavy Atoms17
Complexity263.0
SMILESCC(C)(C)OC(=O)NC(CCSC)CC(=O)O
InChIKeyHBFKPNZCUUZRLA-UHFFFAOYSA-N

Chemical Property Profile of 3-{[(Tert-butoxy)carbonyl]amino}-5-(methylsulfanyl)pentanoic acid

XLogP
1.5
TPSA (Topological Polar Surface Area)
101.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
5
Rotatable Bonds
8
Heavy Atoms
17
Complexity
263.0
Exact Mass
263.11914
Monoisotopic Mass
263.11914
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 3-{[(Tert-butoxy)carbonyl]amino}-5-(methylsulfanyl)pentanoic acid

The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-{[(Tert-butoxy)carbonyl]amino}-5-(methylsulfanyl)pentanoic acid. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{[(Tert-butoxy)carbonyl]amino}-5-(methylsulfanyl)pentanoic acid. Following Lipinski's Rule of Five, 3-{[(Tert-butoxy)carbonyl]amino}-5-(methylsulfanyl)pentanoic acid has 2 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 3-{[(Tert-butoxy)carbonyl]amino}-5-(methylsulfanyl)pentanoic acid?

The CAS number of 3-{[(Tert-butoxy)carbonyl]amino}-5-(methylsulfanyl)pentanoic acid is 1217811-51-2.

What is the molecular formula of 3-{[(Tert-butoxy)carbonyl]amino}-5-(methylsulfanyl)pentanoic acid?

The molecular formula of 3-{[(Tert-butoxy)carbonyl]amino}-5-(methylsulfanyl)pentanoic acid is C11H21NO4S.

What is the molecular weight of 3-{[(Tert-butoxy)carbonyl]amino}-5-(methylsulfanyl)pentanoic acid?

The molecular weight of 3-{[(Tert-butoxy)carbonyl]amino}-5-(methylsulfanyl)pentanoic acid is 263.11914 g/mol.

Where can I buy 3-{[(Tert-butoxy)carbonyl]amino}-5-(methylsulfanyl)pentanoic acid?

You can request a quote for 3-{[(Tert-butoxy)carbonyl]amino}-5-(methylsulfanyl)pentanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 3-{[(Tert-butoxy)carbonyl]amino}-5-(methylsulfanyl)pentanoic acid?

Yes, CoreyChem provides custom synthesis services for 3-{[(Tert-butoxy)carbonyl]amino}-5-(methylsulfanyl)pentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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