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tert-butyl N-[(2S)-1-hydroxy-3-methylbutan-2-yl]carbamate structure
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tert-butyl N-[(2S)-1-hydroxy-3-methylbutan-2-yl]carbamate

TL;DR: tert-butyl N-[(2S)-1-hydroxy-3-methylbutan-2-yl]carbamate (CAS 106391-87-1) is a chemical compound with molecular formula C10H21NO3 and molecular weight 203.15215 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

tert-butyl N-[(2S)-1-hydroxy-3-methylbutan-2-yl]carbamate

Also Known As: N-Boc-L-valinol, Boc-L-valinol, Boc-Valinol, Boc-D-valinol, Boc-Val-ol

CAS Number
106391-87-1
Molecular Formula
C10H21NO3
Molecular Weight
203.15215 g/mol
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Technical Specifications

Molecular FormulaC10H21NO3
Molecular Weight203.15215 g/mol
XLogP1.6
Topological Polar Surface Area (TPSA)58.6 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors3
Rotatable Bonds5
Exact Mass203.15215 Da
Heavy Atoms14
Complexity184.0
SMILESCC(C)[C@@H](CO)NC(=O)OC(C)(C)C
InChIKeyOOQRRYDVICNJGC-MRVPVSSYSA-N

Chemical Property Profile of tert-butyl N-[(2S)-1-hydroxy-3-methylbutan-2-yl]carbamate

XLogP
1.6
TPSA (Topological Polar Surface Area)
58.6
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
Rotatable Bonds
5
Heavy Atoms
14
Complexity
184.0
Exact Mass
203.15215
Monoisotopic Mass
203.15215
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 tert-butyl N-[(2S)-1-hydroxy-3-methylbutan-2-yl]carbamate

The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-butyl N-[(2S)-1-hydroxy-3-methylbutan-2-yl]carbamate. With a topological polar surface area (TPSA) of 58.6 Ų, tert-butyl N-[(2S)-1-hydroxy-3-methylbutan-2-yl]carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, tert-butyl N-[(2S)-1-hydroxy-3-methylbutan-2-yl]carbamate has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of tert-butyl N-[(2S)-1-hydroxy-3-methylbutan-2-yl]carbamate?

The CAS number of tert-butyl N-[(2S)-1-hydroxy-3-methylbutan-2-yl]carbamate is 106391-87-1.

What is the molecular formula of tert-butyl N-[(2S)-1-hydroxy-3-methylbutan-2-yl]carbamate?

The molecular formula of tert-butyl N-[(2S)-1-hydroxy-3-methylbutan-2-yl]carbamate is C10H21NO3.

What is the molecular weight of tert-butyl N-[(2S)-1-hydroxy-3-methylbutan-2-yl]carbamate?

The molecular weight of tert-butyl N-[(2S)-1-hydroxy-3-methylbutan-2-yl]carbamate is 203.15215 g/mol.

Where can I buy tert-butyl N-[(2S)-1-hydroxy-3-methylbutan-2-yl]carbamate?

You can request a quote for tert-butyl N-[(2S)-1-hydroxy-3-methylbutan-2-yl]carbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for tert-butyl N-[(2S)-1-hydroxy-3-methylbutan-2-yl]carbamate?

Yes, CoreyChem provides custom synthesis services for tert-butyl N-[(2S)-1-hydroxy-3-methylbutan-2-yl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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