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1,4-Oxathiin-2-carboxylicacid, 5,6-dihydro- structure
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1,4-Oxathiin-2-carboxylicacid, 5,6-dihydro-

TL;DR: 1,4-Oxathiin-2-carboxylicacid, 5,6-dihydro- (CAS 115595-71-6) is a chemical compound with molecular formula C5H6O3S and molecular weight 146.00377 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2,3-dihydro-1,4-oxathiine-6-carboxylic acid

Also Known As: 2,3-dihydro-1,4-oxathiine-6-carboxylic acid, 5,6-dihydro-1,4-oxathiine-2-carboxylic acid, 1,4-Oxathiin-2-carboxylic acid, 5,6-dihydro-, 1,4-Oxathiin-2-carboxylicacid, 5,6-dihydro-, 1,4-Oxathiin-2-carboxylicacid,5,6-dihydro-(9CI)

CAS Number
115595-71-6
Molecular Formula
C5H6O3S
Molecular Weight
146.00377 g/mol
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Technical Specifications

Molecular FormulaC5H6O3S
Molecular Weight146.00377 g/mol
XLogP0.5
Topological Polar Surface Area (TPSA)71.8 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors4
Rotatable Bonds1
Exact Mass146.00377 Da
Heavy Atoms9
Complexity152.0
SMILESC1CSC=C(O1)C(=O)O
InChIKeyZDMYDHIQFHUAPY-UHFFFAOYSA-N

Chemical Property Profile of 1,4-Oxathiin-2-carboxylicacid, 5,6-dihydro-

XLogP
0.5
TPSA (Topological Polar Surface Area)
71.8
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
4
Rotatable Bonds
1
Heavy Atoms
9
Complexity
152.0
Exact Mass
146.00377
Monoisotopic Mass
146.00377
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 1,4-Oxathiin-2-carboxylicacid, 5,6-dihydro-

The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Oxathiin-2-carboxylicacid, 5,6-dihydro-. The TPSA of 71.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Oxathiin-2-carboxylicacid, 5,6-dihydro-. Following Lipinski's Rule of Five, 1,4-Oxathiin-2-carboxylicacid, 5,6-dihydro- 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 1,4-Oxathiin-2-carboxylicacid, 5,6-dihydro-?

The CAS number of 1,4-Oxathiin-2-carboxylicacid, 5,6-dihydro- is 115595-71-6.

What is the molecular formula of 1,4-Oxathiin-2-carboxylicacid, 5,6-dihydro-?

The molecular formula of 1,4-Oxathiin-2-carboxylicacid, 5,6-dihydro- is C5H6O3S.

What is the molecular weight of 1,4-Oxathiin-2-carboxylicacid, 5,6-dihydro-?

The molecular weight of 1,4-Oxathiin-2-carboxylicacid, 5,6-dihydro- is 146.00377 g/mol.

Where can I buy 1,4-Oxathiin-2-carboxylicacid, 5,6-dihydro-?

You can request a quote for 1,4-Oxathiin-2-carboxylicacid, 5,6-dihydro- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1,4-Oxathiin-2-carboxylicacid, 5,6-dihydro-?

Yes, CoreyChem provides custom synthesis services for 1,4-Oxathiin-2-carboxylicacid, 5,6-dihydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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