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1-Tosylpyrrolidine-2-methanol structure
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1-Tosylpyrrolidine-2-methanol

TL;DR: 1-Tosylpyrrolidine-2-methanol (CAS 134513-04-5) is a chemical compound with molecular formula C12H17NO3S and molecular weight 255.09291 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]methanol

Also Known As: 1-Tosylpyrrolidine-2-methanol, (1-tosylpyrrolidin-2-yl)methanol, Tetrahydropyrrole-2-methanol, N-tosyl-, J1.309.948K, [1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]methanol

CAS Number
134513-04-5
Molecular Formula
C12H17NO3S
Molecular Weight
255.09291 g/mol
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Application Areas

Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.

Heterocyclic Building Blocks (14 patents) Pharmaceutical Intermediates (15 patents)

Technical Specifications

Molecular FormulaC12H17NO3S
Molecular Weight255.09291 g/mol
XLogP1.3
Topological Polar Surface Area (TPSA)66.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors4
Rotatable Bonds3
Exact Mass255.09291 Da
Heavy Atoms17
Complexity341.0
SMILESCC1=CC=C(C=C1)S(=O)(=O)N2CCCC2CO
InChIKeyROHDMTXJNIUWBL-UHFFFAOYSA-N

Chemical Property Profile of 1-Tosylpyrrolidine-2-methanol

XLogP
1.3
TPSA (Topological Polar Surface Area)
66.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
4
Rotatable Bonds
3
Heavy Atoms
17
Complexity
341.0
Exact Mass
255.09291
Monoisotopic Mass
255.09291
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 1-Tosylpyrrolidine-2-methanol

The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Tosylpyrrolidine-2-methanol. The TPSA of 66.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Tosylpyrrolidine-2-methanol. Following Lipinski's Rule of Five, 1-Tosylpyrrolidine-2-methanol has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 1-Tosylpyrrolidine-2-methanol?

The CAS number of 1-Tosylpyrrolidine-2-methanol is 134513-04-5.

What is the molecular formula of 1-Tosylpyrrolidine-2-methanol?

The molecular formula of 1-Tosylpyrrolidine-2-methanol is C12H17NO3S.

What is the molecular weight of 1-Tosylpyrrolidine-2-methanol?

The molecular weight of 1-Tosylpyrrolidine-2-methanol is 255.09291 g/mol.

Where can I buy 1-Tosylpyrrolidine-2-methanol?

You can request a quote for 1-Tosylpyrrolidine-2-methanol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1-Tosylpyrrolidine-2-methanol?

Yes, CoreyChem provides custom synthesis services for 1-Tosylpyrrolidine-2-methanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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